4072379 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 8 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 3 3 4 4 4 5 5 6 6 7 7 8 8 9 9 10 11 12 12 13 13 14 14 15 15 16 16 17 17 18 19 20 20 20 22 23 23 24 24 25 25 21 22 40 26 41 6 7 27 10 11 21 36 8 9 10 12 11 13 14 15 16 28 17 29 18 30 19 31 18 32 19 33 34 35 21 22 23 24 25 37 26 38 26 39 2 1 1 1 1 1 1 1 2 1 1 1 2 1 1 1 1 2 1 2 2 1 1 1 2 1 1 1 1 1 2 1 1 1 1 2 1 1 2 1 2 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 4.666 7.2641 8.9962 4.666 4.666 5.5321 4.666 5.5321 3.8 5.5321 3.8 6.426 2.9061 6.426 2.9061 7.3321 2 7.3321 2 6.3981 5.5321 7.2641 6.3981 8.1301 7.2641 8.1301 4.1291 6.4188 2.9132 6.4188 2.9132 7.8678 1.4643 7.8678 1.4643 6.069 5.8612 8.6671 7.2641 7.801 8.9962 1.4573 -0.0427 2.9573 -0.5427 -3.5427 -0.0427 -1.5427 -2.0427 -2.0427 -3.0427 -3.0427 -1.508 -1.508 -3.5773 -3.5773 -2.0218 -2.0218 -3.0635 -3.0635 1.4573 0.9573 0.9573 2.4573 1.4573 2.9573 2.4573 -0.2327 -0.888 -0.888 -4.1973 -4.1973 -1.7098 -1.7098 -3.3756 -3.3756 -0.3527 2.7673 1.1473 3.5773 -0.3527 3.5773 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 5 5 7 7 8 8 9 9 10 11 12 13 14 15 16 17 20 20 22 23 24 25 10 11 8 9 10 12 11 13 14 15 16 17 18 19 18 19 22 23 24 25 26 26 0 Compound Canonicalized 5 2021.10.14 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 481 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 5 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 4 Count Rotatable Bond 5 E_NROTBONDS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 3 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 00000371C07B30000000000000000000000000000000000000003C60C1000000000000B1FC00001E00180800000C0C819E0030C6F26A1200A803257254008284202522221AB821366CD80827F6C2D5D384754867E015C8D98798FCE4CE20000008000A00004000001000140000000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 N'-acridin-9-yl-2,4-dihydroxy-benzohydrazide IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 N'-(9-acridinyl)-2,4-dihydroxybenzohydrazide IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 <I>N</I>&apos;-acridin-9-yl-2,4-dihydroxybenzohydrazide IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 N'-acridin-9-yl-2,4-dihydroxybenzohydrazide IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 N'-acridin-9-yl-2,4-bis(oxidanyl)benzohydrazide IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 N'-acridin-9-yl-2,4-dihydroxy-benzohydrazide InChI Standard 1 1.0.6 InChI iupac.org 2021.10.14 InChI=1S/C20H15N3O3/c24-12-9-10-15(18(25)11-12)20(26)23-22-19-13-5-1-3-7-16(13)21-17-8-4-2-6-14(17)19/h1-11,24-25H,(H,21,22)(H,23,26) InChIKey Standard 1 1.0.6 InChI iupac.org 2021.10.14 XJFIZXJHVSKWAV-UHFFFAOYSA-N Log P XLogP3-AA 7 3.0 sioc-ccbg.ac.cn 2021.10.14 4.5 Mass Exact 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 345.11134135 Molecular Formula 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 C20H15N3O3 Molecular Weight 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 345.4 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NNC(=O)C4=C(C=C(C=C4)O)O SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NNC(=O)C4=C(C=C(C=C4)O)O Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 94.5 Weight MonoIsotopic 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 345.11134135 26 0 0 0 0 0 0 0 1 -1