67968048 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 8 8 7 7 7 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 3 3 3 4 4 5 5 5 6 6 7 8 8 9 10 10 11 11 12 12 13 13 14 15 16 16 17 17 17 18 18 19 19 20 22 22 22 23 23 24 24 25 26 27 27 27 28 28 28 25 28 21 7 9 12 6 7 14 21 36 8 9 10 13 16 29 11 30 15 22 15 31 14 32 19 33 20 34 18 21 23 24 27 20 35 37 38 39 40 26 41 25 42 26 43 44 45 46 47 48 49 1 1 2 1 1 1 1 2 1 1 1 1 2 1 2 1 1 2 1 1 1 2 1 1 1 2 1 2 1 2 1 1 1 1 1 1 1 1 1 1 2 1 2 1 1 1 1 1 1 1 1 1 1 5 255 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 12.1279 10.6279 4.5981 5.5443 9.1279 6.1279 4.5981 7.1279 5.5443 3.732 2.866 3.732 7.6279 8.6279 2.866 7.6279 10.6279 10.1279 9.1279 8.6279 10.1279 2 11.6279 10.6279 11.6279 12.1279 9.1279 13.1279 5.7369 3.732 3.732 7.3179 2.3291 7.3179 9.7479 8.8179 8.9379 1.69 1.4631 2.31 11.9379 10.3179 12.7479 9.1279 8.5079 9.1279 13.1279 13.7479 13.1279 -3.0981 1.232 2.5981 1.2933 0.366 2.0981 1.5981 2.0981 2.9028 1.0981 1.5981 3.0981 1.232 1.232 2.5981 2.9641 -0.5 -1.366 2.0981 2.9641 0.366 1.0981 -0.5 -2.232 -2.232 -1.366 -1.366 -3.0981 3.4921 0.4781 3.7181 0.6951 2.9081 3.501 2.0981 -0.1709 3.501 1.635 0.7881 0.5611 0.0369 -2.769 -1.366 -0.746 -1.366 -1.986 -3.7181 -3.0981 -2.4781 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 3 3 3 4 4 6 7 8 8 10 11 12 13 14 16 17 17 18 19 23 24 25 7 9 12 6 7 9 10 13 16 11 15 15 14 19 20 18 23 24 20 26 25 26 0 Compound Canonicalized 5 2012.11.26 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 542 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 3 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 1 Count Rotatable Bond 5 E_NROTBONDS 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 4 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 00000371E07B30000000000000000000000000000001600000003C608000000000005801F400001E00100000000C0CC19F063FF69FCC1C00A8033777740082882D3532A009D8213E7CD88C6EF2C4BD9B9431286CD413C8E9A798DC92CEA0000140001000004000028000200000000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 4-methoxy-2-methyl-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 4-methoxy-2-methyl-N-[3-(7-methyl-2-imidazo[1,2-a]pyridinyl)phenyl]benzamide IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 4-methoxy-2-methyl-<I>N</I>-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 4-methoxy-2-methyl-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 4-methoxy-2-methyl-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 4-methoxy-2-methyl-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide InChI Standard 1 1.0.6 InChI iupac.org 2021.05.07 InChI=1S/C23H21N3O2/c1-15-9-10-26-14-21(25-22(26)11-15)17-5-4-6-18(13-17)24-23(27)20-8-7-19(28-3)12-16(20)2/h4-14H,1-3H3,(H,24,27) InChIKey Standard 1 1.0.6 InChI iupac.org 2021.05.07 PIUNJWUVQCRHKJ-UHFFFAOYSA-N Log P XLogP3-AA 7 3.0 sioc-ccbg.ac.cn 2021.05.07 5 Mass Exact 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 371.16337692 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 C23H21N3O2 Molecular Weight 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 371.4 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.05.07 CC1=CC2=NC(=CN2C=C1)C3=CC(=CC=C3)NC(=O)C4=C(C=C(C=C4)OC)C SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.05.07 CC1=CC2=NC(=CN2C=C1)C3=CC(=CC=C3)NC(=O)C4=C(C=C(C=C4)OC)C Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 55.6 Weight MonoIsotopic 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 371.16337692 28 0 0 0 0 0 0 0 1 -1