7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-8H-imidazo[4,5-g]quinoxaline;6-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1H-pyrazolo[3,4-g]quinoxaline;7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-1H-pyrazolo[4,3-g]quinoxaline;N,N-dimethyl-1-[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methanamine;N,N-dimethyl-1-[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methanamine;6-[4-[[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1,3-dihydroimidazo[4,5-g]quinoxalin-2-one;1-[1-[[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-2H-triazolo[4,5-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one

C288H247N57O5 — CID 159413324

IUPAC7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-8H-imidazo[4,5-g]quinoxaline;6-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1H-pyrazolo[3,4-g]quinoxaline;7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-1H-pyrazolo[4,3-g]quinoxaline;N,N-dimethyl-1-[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methanamine;N,N-dimethyl-1-[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methanamine;6-[4-[[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1,3-dihydroimidazo[4,5-g]quinoxalin-2-one;1-[1-[[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-2H-triazolo[4,5-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one
SMILESCN(C)Cc1ccc(-c2nc3cc4[nH]ncc4cc3nc2-c2ccccc2)cc1.CN(C)Cc1ccc(-c2nc3cc4cn[nH]c4cc3nc2-c2ccccc2)cc1.O=C1Cc2ccccc2N1C1CCN(Cc2ccc(-c3nc4cc5[nH]ncc5cc4nc3-c3ccccc3)cc2)CC1.O=C1Cc2ccccc2N1C1CCN(Cc2ccc(-c3nc4cc5cn[nH]c5cc4nc3-c3ccccc3)cc2)CC1.O=C1Cc2ccccc2N1C1CCN(Cc2ccc(-c3nc4cc5n[nH]nc5cc4nc3-c3ccccc3)cc2)CC1.O=c1[nH]c2cc3nc(-c4ccccc4)c(-c4ccc(CN5CCC(n6c(=O)[nH]c7ccccc76)CC5)cc4)nc3cc2[nH]1.c1ccc(-c2nc3cc4[nH]ncc4cc3nc2-c2ccc(CN3CCC(c4nc5ccccc5[nH]4)CC3)cc2)cc1.c1ccc(-c2nc3cc4cn[nH]c4cc3nc2-c2ccc(CN3CCC(c4nc5ccccc5[nH]4)CC3)cc2)cc1.c1ccc(-c2nc3cc4ncnc4cc3[nH]c2-c2ccc(CN3CCC(c4nc5ccccc5[nH]4)CC3)cc2)cc1
InChIInChI=1S/2C35H30N6O.C34H29N7O2.C34H29N7O.3C34H29N7.2C24H21N5/c42-33-19-26-8-4-5-9-32(26)41(33)28-14-16-40(17-15-28)22-23-10-12-25(13-11-23)35-34(24-6-2-1-3-7-24)38-31-20-29-27(21-36-39-29)18-30(31)37-35;42-33-19-26-8-4-5-9-32(26)41(33)28-14-16-40(17-15-28)22-23-10-12-25(13-11-23)35-34(24-6-2-1-3-7-24)37-30-18-27-21-36-39-29(27)20-31(30)38-35;42-33-37-28-18-26-27(19-29(28)38-33)36-32(31(35-26)22-6-2-1-3-7-22)23-12-10-21(11-13-23)20-40-16-14-24(15-17-40)41-30-9-5-4-8-25(30)39-34(41)43;42-32-18-25-8-4-5-9-31(25)41(32)26-14-16-40(17-15-26)21-22-10-12-24(13-11-22)34-33(23-6-2-1-3-7-23)35-27-19-29-30(38-39-37-29)20-28(27)36-34;1-2-6-23(7-3-1)32-33(36-30-18-26-20-35-40-29(26)19-31(30)37-32)24-12-10-22(11-13-24)21-41-16-14-25(15-17-41)34-38-27-8-4-5-9-28(27)39-34;1-2-6-23(7-3-1)32-33(37-31-19-29-26(20-35-40-29)18-30(31)36-32)24-12-10-22(11-13-24)21-41-16-14-25(15-17-41)34-38-27-8-4-5-9-28(27)39-34;1-2-6-23(7-3-1)32-33(38-31-19-29-28(35-21-36-29)18-30(31)37-32)24-12-10-22(11-13-24)20-41-16-14-25(15-17-41)34-39-26-8-4-5-9-27(26)40-34;1-29(2)15-16-8-10-18(11-9-16)24-23(17-6-4-3-5-7-17)27-22-13-20-19(14-25-28-20)12-21(22)26-24;1-29(2)15-16-8-10-18(11-9-16)24-23(17-6-4-3-5-7-17)26-21-12-19-14-25-28-20(19)13-22(21)27-24/h2*1-13,18,20-21,28H,14-17,19,22H2,(H,36,39);1-13,18-19,24H,14-17,20H2,(H,39,43)(H2,37,38,42);1-13,19-20,26H,14-18,21H2,(H,37,38,39);2*1-13,18-20,25H,14-17,21H2,(H,35,40)(H,38,39);1-13,18-19,21,25,38H,14-17,20H2,(H,39,40);2*3-14H,15H2,1-2H3,(H,25,28)
InChIKeyJEOJSWPPLMOCJY-UHFFFAOYSA-N
MW4586.54 g/mol
LogP55.28
Rot. Bonds43

About 7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-8H-imidazo[4,5-g]quinoxaline;6-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1H-pyrazolo[3,4-g]quinoxaline;7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-1H-pyrazolo[4,3-g]quinoxaline;N,N-dimethyl-1-[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methanamine;N,N-dimethyl-1-[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methanamine;6-[4-[[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1,3-dihydroimidazo[4,5-g]quinoxalin-2-one;1-[1-[[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-2H-triazolo[4,5-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one

7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-8H-imidazo[4,5-g]quinoxaline;6-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1H-pyrazolo[3,4-g]quinoxaline;7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-1H-pyrazolo[4,3-g]quinoxaline;N,N-dimethyl-1-[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methanamine;N,N-dimethyl-1-[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methanamine;6-[4-[[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1,3-dihydroimidazo[4,5-g]quinoxalin-2-one;1-[1-[[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-2H-triazolo[4,5-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one (PubChem CID 159413324) has the molecular formula C288H247N57O5 and a molecular weight of 4586.54 g/mol. Its IUPAC name is 7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-8H-imidazo[4,5-g]quinoxaline;6-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1H-pyrazolo[3,4-g]quinoxaline;7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-1H-pyrazolo[4,3-g]quinoxaline;N,N-dimethyl-1-[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methanamine;N,N-dimethyl-1-[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methanamine;6-[4-[[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1,3-dihydroimidazo[4,5-g]quinoxalin-2-one;1-[1-[[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-2H-triazolo[4,5-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one.

Molecular Properties

Compound Name7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-8H-imidazo[4,5-g]quinoxaline;6-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1H-pyrazolo[3,4-g]quinoxaline;7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-1H-pyrazolo[4,3-g]quinoxaline;N,N-dimethyl-1-[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methanamine;N,N-dimethyl-1-[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methanamine;6-[4-[[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1,3-dihydroimidazo[4,5-g]quinoxalin-2-one;1-[1-[[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-2H-triazolo[4,5-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one
PubChem CID159413324
Molecular FormulaC288H247N57O5
Molecular Weight4586.54 g/mol
Exact Mass4583.08
IUPAC Name7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-8H-imidazo[4,5-g]quinoxaline;6-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1H-pyrazolo[3,4-g]quinoxaline;7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-1H-pyrazolo[4,3-g]quinoxaline;N,N-dimethyl-1-[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methanamine;N,N-dimethyl-1-[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methanamine;6-[4-[[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1,3-dihydroimidazo[4,5-g]quinoxalin-2-one;1-[1-[[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-2H-triazolo[4,5-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one
SMILESCN(C)Cc1ccc(-c2nc3cc4[nH]ncc4cc3nc2-c2ccccc2)cc1.CN(C)Cc1ccc(-c2nc3cc4cn[nH]c4cc3nc2-c2ccccc2)cc1.O=C1Cc2ccccc2N1C1CCN(Cc2ccc(-c3nc4cc5[nH]ncc5cc4nc3-c3ccccc3)cc2)CC1.O=C1Cc2ccccc2N1C1CCN(Cc2ccc(-c3nc4cc5cn[nH]c5cc4nc3-c3ccccc3)cc2)CC1.O=C1Cc2ccccc2N1C1CCN(Cc2ccc(-c3nc4cc5n[nH]nc5cc4nc3-c3ccccc3)cc2)CC1.O=c1[nH]c2cc3nc(-c4ccccc4)c(-c4ccc(CN5CCC(n6c(=O)[nH]c7ccccc76)CC5)cc4)nc3cc2[nH]1.c1ccc(-c2nc3cc4[nH]ncc4cc3nc2-c2ccc(CN3CCC(c4nc5ccccc5[nH]4)CC3)cc2)cc1.c1ccc(-c2nc3cc4cn[nH]c4cc3nc2-c2ccc(CN3CCC(c4nc5ccccc5[nH]4)CC3)cc2)cc1.c1ccc(-c2nc3cc4ncnc4cc3[nH]c2-c2ccc(CN3CCC(c4nc5ccccc5[nH]4)CC3)cc2)cc1
InChIInChI=1S/2C35H30N6O.C34H29N7O2.C34H29N7O.3C34H29N7.2C24H21N5/c42-33-19-26-8-4-5-9-32(26)41(33)28-14-16-40(17-15-28)22-23-10-12-25(13-11-23)35-34(24-6-2-1-3-7-24)38-31-20-29-27(21-36-39-29)18-30(31)37-35;42-33-19-26-8-4-5-9-32(26)41(33)28-14-16-40(17-15-28)22-23-10-12-25(13-11-23)35-34(24-6-2-1-3-7-24)37-30-18-27-21-36-39-29(27)20-31(30)38-35;42-33-37-28-18-26-27(19-29(28)38-33)36-32(31(35-26)22-6-2-1-3-7-22)23-12-10-21(11-13-23)20-40-16-14-24(15-17-40)41-30-9-5-4-8-25(30)39-34(41)43;42-32-18-25-8-4-5-9-31(25)41(32)26-14-16-40(17-15-26)21-22-10-12-24(13-11-22)34-33(23-6-2-1-3-7-23)35-27-19-29-30(38-39-37-29)20-28(27)36-34;1-2-6-23(7-3-1)32-33(36-30-18-26-20-35-40-29(26)19-31(30)37-32)24-12-10-22(11-13-24)21-41-16-14-25(15-17-41)34-38-27-8-4-5-9-28(27)39-34;1-2-6-23(7-3-1)32-33(37-31-19-29-26(20-35-40-29)18-30(31)36-32)24-12-10-22(11-13-24)21-41-16-14-25(15-17-41)34-38-27-8-4-5-9-28(27)39-34;1-2-6-23(7-3-1)32-33(38-31-19-29-28(35-21-36-29)18-30(31)37-32)24-12-10-22(11-13-24)20-41-16-14-25(15-17-41)34-39-26-8-4-5-9-27(26)40-34;1-29(2)15-16-8-10-18(11-9-16)24-23(17-6-4-3-5-7-17)27-22-13-20-19(14-25-28-20)12-21(22)26-24;1-29(2)15-16-8-10-18(11-9-16)24-23(17-6-4-3-5-7-17)26-21-12-19-14-25-28-20(19)13-22(21)27-24/h2*1-13,18,20-21,28H,14-17,19,22H2,(H,36,39);1-13,18-19,24H,14-17,20H2,(H,39,43)(H2,37,38,42);1-13,19-20,26H,14-18,21H2,(H,37,38,39);2*1-13,18-20,25H,14-17,21H2,(H,35,40)(H,38,39);1-13,18-19,21,25,38H,14-17,20H2,(H,39,40);2*3-14H,15H2,1-2H3,(H,25,28)
InChIKeyJEOJSWPPLMOCJY-UHFFFAOYSA-N
XLogP55.28
TPSA736.92 Ų
H-Bond Donors14
H-Bond Acceptors45
Rotatable Bonds43
Heavy Atoms350
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004586.54
LogP ≤ 555.28
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1045

Analyze 7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-8H-imidazo[4,5-g]quinoxaline;6-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1H-pyrazolo[3,4-g]quinoxaline;7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-1H-pyrazolo[4,3-g]quinoxaline;N,N-dimethyl-1-[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methanamine;N,N-dimethyl-1-[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methanamine;6-[4-[[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1,3-dihydroimidazo[4,5-g]quinoxalin-2-one;1-[1-[[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-2H-triazolo[4,5-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one with MolForge

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Related Compounds

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CID 58142797
2-[(3R)-3-[3-(4-fluorophenyl)-1H-pyrazolo[5,4-g]quinazolin-6-yl]pyrrolidin-1-yl]-1-[(1S,4S)-5-[4-(5-methylpyrimidin-2-yl)phenyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]ethanone
CID 68072922
1-[(1S,4S)-5-[4-(5-fluoropyrimidin-2-yl)phenyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]-2-[(3R)-3-(3-pyridin-4-yl-1H-pyrazolo[5,4-g]quinazolin-6-yl)pyrrolidin-1-yl]ethanone
CID 70792638
N-[5-[3-[7-[3-[2-(dimethylamino)ethylamino]-5-fluorophenyl]-3H-imidazo[4,5-c]pyridin-2-yl]-1-[2-[3-fluoro-5-[2-[5-[5-(propan-2-ylamino)-3-pyridinyl]-1H-indazol-3-yl]-3H-imidazo[4,5-c]pyridin-7-yl]anilino]ethyl-methylamino]indazol-5-yl]-3-pyridinyl]-2-methylpropanamide
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N-[5-[3-[7-[3-[2-[[5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-3-[7-[3-[2-(dimethylamino)ethylamino]-5-fluorophenyl]-3H-imidazo[4,5-c]pyridin-2-yl]indazol-1-yl]-methylamino]ethylamino]-5-fluorophenyl]-3H-imidazo[4,5-c]pyridin-2-yl]-1H-indazol-5-yl]-3-pyridinyl]cyclohexanecarboxamide
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N-[5-[3-[4-(4-fluorophenyl)-6,7-dihydro-1H-benzimidazol-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]-3-[7-(4-fluorophenyl)-2-[5-[6-(propanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-1H-benzimidazol-4-yl]-2-methylpropanamide
CID 137138729
N-[5-[3-[4-(4-fluorophenyl)-1H-benzimidazol-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]-3-[7-(4-fluorophenyl)-2-[5-[6-(propanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-1H-benzimidazol-4-yl]-2-methylpropanamide
CID 137156192
N-[5-[3-[4-(4-fluorophenyl)-1H-benzimidazol-2-yl]-7-[2-fluoro-5-[2-[5-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-1H-indazol-3-yl]-1H-benzimidazol-4-yl]phenyl]-1H-indazol-5-yl]-3-pyridinyl]benzamide
CID 144667648
N-[5-[4-fluoro-7-[1-[2-[4-fluoro-5-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-1H-pyrazolo[3,4-c]pyridin-3-yl]-1H-benzimidazol-4-yl]piperidin-3-yl]-3-(4-piperidin-1-yl-1H-benzimidazol-2-yl)-2H-pyrazolo[3,4-c]pyridin-5-yl]-3-pyridinyl]benzamide
CID 145033350
N-[5-[1-[2-[3-[2-[5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]pyridin-3-yl]-4-fluoro-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridin-4-yl]-5-fluoroanilino]ethyl-methylamino]-4-[4-[3-[2-(dimethylamino)ethylamino]-5-fluorophenyl]-1H-imidazo[4,5-c]pyridin-2-yl]-5-fluoro-2H-quinolin-6-yl]pyridin-3-yl]cyclohexanecarboxamide
CID 145034647
N-[5-[6-fluoro-7-[4-[2-[6-fluoro-5-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridin-4-yl]-2-pyridinyl]-3-(4-pyridin-4-yl-1H-imidazo[4,5-c]pyridin-2-yl)-1H-indazol-5-yl]-3-pyridinyl]benzamide
CID 145034654
N-[5-[6-fluoro-7-[2-fluoro-5-[2-[6-fluoro-5-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridin-4-yl]phenyl]-3-[4-(4-fluorophenyl)-1H-imidazo[4,5-c]pyridin-2-yl]-1H-indazol-5-yl]-3-pyridinyl]benzamide
CID 145034805

Frequently Asked Questions

What is the IUPAC name of 7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-8H-imidazo[4,5-g]quinoxaline;6-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1H-pyrazolo[3,4-g]quinoxaline;7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-1H-pyrazolo[4,3-g]quinoxaline;N,N-dimethyl-1-[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methanamine;N,N-dimethyl-1-[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methanamine;6-[4-[[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1,3-dihydroimidazo[4,5-g]quinoxalin-2-one;1-[1-[[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-2H-triazolo[4,5-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one?
The IUPAC name of 7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-8H-imidazo[4,5-g]quinoxaline;6-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1H-pyrazolo[3,4-g]quinoxaline;7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-1H-pyrazolo[4,3-g]quinoxaline;N,N-dimethyl-1-[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methanamine;N,N-dimethyl-1-[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methanamine;6-[4-[[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1,3-dihydroimidazo[4,5-g]quinoxalin-2-one;1-[1-[[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-2H-triazolo[4,5-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one (CID 159413324) is 7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-8H-imidazo[4,5-g]quinoxaline;6-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1H-pyrazolo[3,4-g]quinoxaline;7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-1H-pyrazolo[4,3-g]quinoxaline;N,N-dimethyl-1-[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methanamine;N,N-dimethyl-1-[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methanamine;6-[4-[[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1,3-dihydroimidazo[4,5-g]quinoxalin-2-one;1-[1-[[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-2H-triazolo[4,5-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one.
What is the SMILES notation for 7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-8H-imidazo[4,5-g]quinoxaline;6-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1H-pyrazolo[3,4-g]quinoxaline;7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-1H-pyrazolo[4,3-g]quinoxaline;N,N-dimethyl-1-[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methanamine;N,N-dimethyl-1-[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methanamine;6-[4-[[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1,3-dihydroimidazo[4,5-g]quinoxalin-2-one;1-[1-[[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-2H-triazolo[4,5-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one?
The canonical SMILES for 7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-8H-imidazo[4,5-g]quinoxaline;6-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1H-pyrazolo[3,4-g]quinoxaline;7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-1H-pyrazolo[4,3-g]quinoxaline;N,N-dimethyl-1-[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methanamine;N,N-dimethyl-1-[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methanamine;6-[4-[[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1,3-dihydroimidazo[4,5-g]quinoxalin-2-one;1-[1-[[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-2H-triazolo[4,5-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one is CN(C)Cc1ccc(-c2nc3cc4[nH]ncc4cc3nc2-c2ccccc2)cc1.CN(C)Cc1ccc(-c2nc3cc4cn[nH]c4cc3nc2-c2ccccc2)cc1.O=C1Cc2ccccc2N1C1CCN(Cc2ccc(-c3nc4cc5[nH]ncc5cc4nc3-c3ccccc3)cc2)CC1.O=C1Cc2ccccc2N1C1CCN(Cc2ccc(-c3nc4cc5cn[nH]c5cc4nc3-c3ccccc3)cc2)CC1.O=C1Cc2ccccc2N1C1CCN(Cc2ccc(-c3nc4cc5n[nH]nc5cc4nc3-c3ccccc3)cc2)CC1.O=c1[nH]c2cc3nc(-c4ccccc4)c(-c4ccc(CN5CCC(n6c(=O)[nH]c7ccccc76)CC5)cc4)nc3cc2[nH]1.c1ccc(-c2nc3cc4[nH]ncc4cc3nc2-c2ccc(CN3CCC(c4nc5ccccc5[nH]4)CC3)cc2)cc1.c1ccc(-c2nc3cc4cn[nH]c4cc3nc2-c2ccc(CN3CCC(c4nc5ccccc5[nH]4)CC3)cc2)cc1.c1ccc(-c2nc3cc4ncnc4cc3[nH]c2-c2ccc(CN3CCC(c4nc5ccccc5[nH]4)CC3)cc2)cc1.
What is the InChIKey of 7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-8H-imidazo[4,5-g]quinoxaline;6-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1H-pyrazolo[3,4-g]quinoxaline;7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-1H-pyrazolo[4,3-g]quinoxaline;N,N-dimethyl-1-[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methanamine;N,N-dimethyl-1-[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methanamine;6-[4-[[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1,3-dihydroimidazo[4,5-g]quinoxalin-2-one;1-[1-[[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-2H-triazolo[4,5-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one?
The InChIKey is JEOJSWPPLMOCJY-UHFFFAOYSA-N. The full InChI is InChI=1S/2C35H30N6O.C34H29N7O2.C34H29N7O.3C34H29N7.2C24H21N5/c42-33-19-26-8-4-5-9-32(26)41(33)28-14-16-40(17-15-28)22-23-10-12-25(13-11-23)35-34(24-6-2-1-3-7-24)38-31-20-29-27(21-36-39-29)18-30(31)37-35;42-33-19-26-8-4-5-9-32(26)41(33)28-14-16-40(17-15-28)22-23-10-12-25(13-11-23)35-34(24-6-2-1-3-7-24)37-30-18-27-21-36-39-29(27)20-31(30)38-35;42-33-37-28-18-26-27(19-29(28)38-33)36-32(31(35-26)22-6-2-1-3-7-22)23-12-10-21(11-13-23)20-40-16-14-24(15-17-40)41-30-9-5-4-8-25(30)39-34(41)43;42-32-18-25-8-4-5-9-31(25)41(32)26-14-16-40(17-15-26)21-22-10-12-24(13-11-22)34-33(23-6-2-1-3-7-23)35-27-19-29-30(38-39-37-29)20-28(27)36-34;1-2-6-23(7-3-1)32-33(36-30-18-26-20-35-40-29(26)19-31(30)37-32)24-12-10-22(11-13-24)21-41-16-14-25(15-17-41)34-38-27-8-4-5-9-28(27)39-34;1-2-6-23(7-3-1)32-33(37-31-19-29-26(20-35-40-29)18-30(31)36-32)24-12-10-22(11-13-24)21-41-16-14-25(15-17-41)34-38-27-8-4-5-9-28(27)39-34;1-2-6-23(7-3-1)32-33(38-31-19-29-28(35-21-36-29)18-30(31)37-32)24-12-10-22(11-13-24)20-41-16-14-25(15-17-41)34-39-26-8-4-5-9-27(26)40-34;1-29(2)15-16-8-10-18(11-9-16)24-23(17-6-4-3-5-7-17)27-22-13-20-19(14-25-28-20)12-21(22)26-24;1-29(2)15-16-8-10-18(11-9-16)24-23(17-6-4-3-5-7-17)26-21-12-19-14-25-28-20(19)13-22(21)27-24/h2*1-13,18,20-21,28H,14-17,19,22H2,(H,36,39);1-13,18-19,24H,14-17,20H2,(H,39,43)(H2,37,38,42);1-13,19-20,26H,14-18,21H2,(H,37,38,39);2*1-13,18-20,25H,14-17,21H2,(H,35,40)(H,38,39);1-13,18-19,21,25,38H,14-17,20H2,(H,39,40);2*3-14H,15H2,1-2H3,(H,25,28).
What are the key properties of 7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-8H-imidazo[4,5-g]quinoxaline;6-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1H-pyrazolo[3,4-g]quinoxaline;7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-1H-pyrazolo[4,3-g]quinoxaline;N,N-dimethyl-1-[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methanamine;N,N-dimethyl-1-[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methanamine;6-[4-[[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1,3-dihydroimidazo[4,5-g]quinoxalin-2-one;1-[1-[[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-2H-triazolo[4,5-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one?
7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-8H-imidazo[4,5-g]quinoxaline;6-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1H-pyrazolo[3,4-g]quinoxaline;7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-1H-pyrazolo[4,3-g]quinoxaline;N,N-dimethyl-1-[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methanamine;N,N-dimethyl-1-[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methanamine;6-[4-[[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1,3-dihydroimidazo[4,5-g]quinoxalin-2-one;1-[1-[[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-2H-triazolo[4,5-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one has a molecular weight of 4586.54 g/mol, XLogP of 55.28, 43 rotatable bonds, 14 hydrogen bond donors, and 45 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-8H-imidazo[4,5-g]quinoxaline;6-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1H-pyrazolo[3,4-g]quinoxaline;7-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]phenyl]-6-phenyl-1H-pyrazolo[4,3-g]quinoxaline;N,N-dimethyl-1-[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methanamine;N,N-dimethyl-1-[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methanamine;6-[4-[[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]methyl]phenyl]-7-phenyl-1,3-dihydroimidazo[4,5-g]quinoxalin-2-one;1-[1-[[4-(6-phenyl-1H-pyrazolo[4,3-g]quinoxalin-7-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one;1-[1-[[4-(7-phenyl-2H-triazolo[4,5-g]quinoxalin-6-yl)phenyl]methyl]piperidin-4-yl]-3H-indol-2-one is sourced from PubChem (CID 159413324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).