70027035 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 7 7 7 7 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 2 2 3 3 4 4 5 5 6 6 7 8 9 10 11 11 12 12 13 14 15 15 16 16 17 17 18 18 19 5 14 22 6 11 8 13 7 14 7 9 8 9 10 10 20 21 12 13 15 16 23 24 17 25 18 26 19 27 19 28 29 1 1 1 2 1 2 1 1 2 1 2 1 1 2 1 1 1 1 2 2 1 1 1 1 1 2 1 2 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 9.0744 5.5022 5.5022 9.0744 8.1282 6.3961 8.1282 6.3961 7.2622 7.2622 4.5961 3.732 4.5961 9.658 3.7359 2.8641 2.8718 2 2.0038 7.2622 7.2622 9.267 4.0604 10.278 4.274 2.8617 2.8742 1.4619 1.4681 0.0583 0.2883 -1.7811 -1.5511 -0.2464 -0.2464 -1.2464 -1.2464 0.2536 -1.7464 -0.2256 0.2777 -1.2672 -0.7464 1.2777 -0.2189 1.7811 0.2844 1.2844 0.8736 -2.3664 0.6476 -1.5793 -0.7464 1.5857 -0.8389 2.4011 -0.0235 1.5965 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 1 1 2 2 3 3 4 4 5 5 6 6 7 8 11 12 12 15 16 17 18 5 14 6 11 8 13 7 14 7 9 8 9 10 10 13 15 16 17 18 19 19 0 Compound Canonicalized 5 2012.11.26 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 315 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 1 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 00000371C07380000000000000000000000000000001600000003C6080000000000058B1FE00001C00100000000C08C11E043DD0B6C99000A0033467640082802DB112A009D9A03874988868E2C0D9D1942408689002C8C8271080800E00008000040000200001000008000040000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 6-phenyl-3H-imidazo[4,5-g]quinoxaline IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 6-phenyl-3H-imidazo[4,5-g]quinoxaline IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 6-phenyl-3<I>H</I>-imidazo[4,5-g]quinoxaline IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 6-phenyl-3H-imidazo[4,5-g]quinoxaline IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 6-phenyl-3H-imidazo[4,5-g]quinoxaline IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 6-phenyl-3H-imidazo[4,5-g]quinoxaline InChI Standard 1 1.0.6 InChI iupac.org 2021.05.07 InChI=1S/C15H10N4/c1-2-4-10(5-3-1)15-8-16-13-6-11-12(18-9-17-11)7-14(13)19-15/h1-9H,(H,17,18) InChIKey Standard 1 1.0.6 InChI iupac.org 2021.05.07 YRZAEQSYZHWCRC-UHFFFAOYSA-N Log P XLogP3-AA 7 3.0 sioc-ccbg.ac.cn 2021.05.07 2.4 Mass Exact 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 246.090546336 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 C15H10N4 Molecular Weight 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 246.27 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.05.07 C1=CC=C(C=C1)C2=CN=C3C=C4C(=CC3=N2)NC=N4 SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.05.07 C1=CC=C(C=C1)C2=CN=C3C=C4C(=CC3=N2)NC=N4 Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 54.5 Weight MonoIsotopic 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 246.090546336 19 0 0 0 0 0 0 0 1 -1