(5-chloro-1H-indol-2-yl)-(3-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone;[4-[[4-(1,1-difluoroethyl)-3-fluorophenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[(2-fluoro-4-methylphenyl)methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone

C112H101ClF22N16O5 — CID 159761873

IUPAC(5-chloro-1H-indol-2-yl)-(3-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone;[4-[[4-(1,1-difluoroethyl)-3-fluorophenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[(2-fluoro-4-methylphenyl)methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone
SMILESCC(F)(F)c1ccc(CN2CCN(C(=O)c3cc4cc(C(F)(F)F)ccc4[nH]3)CC2)cc1F.Cc1ccc(CN2CCN(C(=O)c3cc4cc(C(F)(F)F)ccc4[nH]3)CC2)c(C(F)(F)F)c1.Cc1ccc(CN2CCN(C(=O)c3cc4cc(C(F)(F)F)ccc4[nH]3)CC2)c(F)c1.Cc1ccc(CN2CCN(C(=O)c3cc4cc(C(F)(F)F)ccc4[nH]3)CC2)cc1C(F)(F)F.O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCn2c(-c3ccccc3)cnc2C1
InChIInChI=1S/3C23H21F6N3O.C22H21F4N3O.C21H17ClN4O/c1-22(25,26)17-4-2-14(10-18(17)24)13-31-6-8-32(9-7-31)21(33)20-12-15-11-16(23(27,28)29)3-5-19(15)30-20;1-14-2-3-15(10-18(14)23(27,28)29)13-31-6-8-32(9-7-31)21(33)20-12-16-11-17(22(24,25)26)4-5-19(16)30-20;1-14-2-3-15(18(10-14)23(27,28)29)13-31-6-8-32(9-7-31)21(33)20-12-16-11-17(22(24,25)26)4-5-19(16)30-20;1-14-2-3-15(18(23)10-14)13-28-6-8-29(9-7-28)21(30)20-12-16-11-17(22(24,25)26)4-5-19(16)27-20;22-16-6-7-17-15(10-16)11-18(24-17)21(27)25-8-9-26-19(12-23-20(26)13-25)14-4-2-1-3-5-14/h3*2-5,10-12,30H,6-9,13H2,1H3;2-5,10-12,27H,6-9,13H2,1H3;1-7,10-12,24H,8-9,13H2
InChIKeyNEZNJBLAVNBBIG-UHFFFAOYSA-N
MW2204.56 g/mol
LogP25.27
Rot. Bonds15

About (5-chloro-1H-indol-2-yl)-(3-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone;[4-[[4-(1,1-difluoroethyl)-3-fluorophenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[(2-fluoro-4-methylphenyl)methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone

(5-chloro-1H-indol-2-yl)-(3-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone;[4-[[4-(1,1-difluoroethyl)-3-fluorophenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[(2-fluoro-4-methylphenyl)methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone (PubChem CID 159761873) has the molecular formula C112H101ClF22N16O5 and a molecular weight of 2204.56 g/mol. Its IUPAC name is (5-chloro-1H-indol-2-yl)-(3-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone;[4-[[4-(1,1-difluoroethyl)-3-fluorophenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[(2-fluoro-4-methylphenyl)methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone.

Molecular Properties

Compound Name(5-chloro-1H-indol-2-yl)-(3-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone;[4-[[4-(1,1-difluoroethyl)-3-fluorophenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[(2-fluoro-4-methylphenyl)methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone
PubChem CID159761873
Molecular FormulaC112H101ClF22N16O5
Molecular Weight2204.56 g/mol
Exact Mass2202.75
IUPAC Name(5-chloro-1H-indol-2-yl)-(3-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone;[4-[[4-(1,1-difluoroethyl)-3-fluorophenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[(2-fluoro-4-methylphenyl)methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone
SMILESCC(F)(F)c1ccc(CN2CCN(C(=O)c3cc4cc(C(F)(F)F)ccc4[nH]3)CC2)cc1F.Cc1ccc(CN2CCN(C(=O)c3cc4cc(C(F)(F)F)ccc4[nH]3)CC2)c(C(F)(F)F)c1.Cc1ccc(CN2CCN(C(=O)c3cc4cc(C(F)(F)F)ccc4[nH]3)CC2)c(F)c1.Cc1ccc(CN2CCN(C(=O)c3cc4cc(C(F)(F)F)ccc4[nH]3)CC2)cc1C(F)(F)F.O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCn2c(-c3ccccc3)cnc2C1
InChIInChI=1S/3C23H21F6N3O.C22H21F4N3O.C21H17ClN4O/c1-22(25,26)17-4-2-14(10-18(17)24)13-31-6-8-32(9-7-31)21(33)20-12-15-11-16(23(27,28)29)3-5-19(15)30-20;1-14-2-3-15(10-18(14)23(27,28)29)13-31-6-8-32(9-7-31)21(33)20-12-16-11-17(22(24,25)26)4-5-19(16)30-20;1-14-2-3-15(18(10-14)23(27,28)29)13-31-6-8-32(9-7-31)21(33)20-12-16-11-17(22(24,25)26)4-5-19(16)30-20;1-14-2-3-15(18(23)10-14)13-28-6-8-29(9-7-28)21(30)20-12-16-11-17(22(24,25)26)4-5-19(16)27-20;22-16-6-7-17-15(10-16)11-18(24-17)21(27)25-8-9-26-19(12-23-20(26)13-25)14-4-2-1-3-5-14/h3*2-5,10-12,30H,6-9,13H2,1H3;2-5,10-12,27H,6-9,13H2,1H3;1-7,10-12,24H,8-9,13H2
InChIKeyNEZNJBLAVNBBIG-UHFFFAOYSA-N
XLogP25.27
TPSA211.28 Ų
H-Bond Donors5
H-Bond Acceptors11
Rotatable Bonds15
Heavy Atoms156
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002204.56
LogP ≤ 525.27
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1011

Analyze (5-chloro-1H-indol-2-yl)-(3-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone;[4-[[4-(1,1-difluoroethyl)-3-fluorophenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[(2-fluoro-4-methylphenyl)methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-methyl-N-[3-(4-methylimidazol-1-yl)-5-(trifluoromethyl)phenyl]-3-[(5-methyl-2-pyridin-3-ylpyrrolo[3,2-d]pyrimidin-4-yl)amino]benzamide;4-methyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]-3-[(5-methyl-2-pyridin-3-ylpyrrolo[3,2-d]pyrimidin-4-yl)amino]benzamide;2-[4-methyl-3-[(5-methyl-2-pyridin-4-ylpyrrolo[3,2-d]pyrimidin-4-yl)amino]phenyl]-1-[3-(trifluoromethyl)phenyl]ethanone;4-methyl-3-[(5-methyl-2-pyridin-3-ylpyrrolo[3,2-d]pyrimidin-4-yl)amino]-N-[3-(trifluoromethyl)phenyl]benzamide;4-methyl-3-[(5-methyl-2-pyridin-4-ylpyrrolo[3,2-d]pyrimidin-4-yl)amino]-N-[3-(trifluoromethyl)phenyl]benzamide
CID 157053327
6-tert-butyl-5-chloro-1H-indole;6-tert-butyl-5-ethyl-1H-indole;6-tert-butyl-5-fluoro-1H-indole;(6-tert-butyl-1H-indol-5-yl)-piperidin-1-ylmethanone;3-tert-butylisoquinoline;4-tert-butyl-3-methyl-1H-indole;6-tert-butyl-2-phenyl-1H-benzimidazole;6-tert-butyl-5-(trifluoromethyl)-1H-indole;5,6-ditert-butyl-1H-indole
CID 157117170
(4R)-4-[3-[3-(1-aminoethenyl)-4-fluorophenyl]-2-pyridinyl]-5-(3,5-difluorophenyl)-1-(5,6-dimethylisoindol-2-yl)pentan-2-one;3-[2-[(2R)-5-[6-(aminomethyl)-1H-indol-3-yl]-1-(3,5-difluorophenyl)-4-oxopentan-2-yl]-3-pyridinyl]-N-methylbenzamide;5-[2-[(1S)-1-[[2-(5-chloroindol-1-yl)acetyl]amino]-2-(3,5-difluorophenyl)ethyl]-3-pyridinyl]-2-fluoro-N-methylbenzamide;5-[2-[(1S)-2-(3,5-difluorophenyl)-1-[2-(5,6-dimethylbenzimidazol-1-yl)butanoylamino]ethyl]-3-pyridinyl]-2-fluoro-N-methylbenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-7-methyl-4-oxo-5-[3-(trifluoromethyl)pyrazol-1-yl]octan-2-yl]-3-pyridinyl]-2-fluoro-N-methylbenzamide
CID 157158955
(5-chloro-1H-indazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(5,6-difluoro-1H-indazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;1H-imidazol-5-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(5-methyl-1H-indazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(7-methyl-2H-indazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;2H-pyrazolo[3,4-b]pyridin-3-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;1H-pyrrolo[3,2-b]pyridin-2-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;1H-pyrrolo[2,3-c]pyridin-2-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone
CID 157188127
5-[3-(4-cyano-2-pyridinyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3-(1-methylimidazol-4-yl)imidazo[1,5-a]pyridin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;2-methyl-5-[3-(1-methylimidazol-4-yl)imidazo[1,5-a]pyridin-8-yl]-N-(4-methylphenyl)benzamide;N-(4-methylphenyl)-5-[3-(3-methyltriazol-4-yl)imidazo[1,5-a]pyridin-8-yl]-2-(trifluoromethyl)benzamide
CID 157212945
1H-indol-2-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;tetrakis((6-methyl-1H-pyrrolo[3,2-b]pyridin-2-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone);1H-pyrrolo[2,3-b]pyridin-2-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;1H-pyrrolo[3,2-b]pyridin-2-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;1H-pyrrolo[2,3-c]pyridin-2-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone
CID 157255418
N-[2-fluoro-5-(trifluoromethyl)phenyl]-4-methyl-3-[(4-pyridin-3-yl-5H-pyrrolo[3,2-d]pyrimidin-2-yl)methyl]benzamide;4-methyl-N-[3-methyl-5-(4-methylimidazol-1-yl)phenyl]-3-[(4-pyridin-3-yl-5H-pyrrolo[3,2-d]pyrimidin-2-yl)methyl]benzamide;4-methyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]-3-[(4-pyridin-3-yl-5H-pyrrolo[3,2-d]pyrimidin-2-yl)methyl]benzamide;4-methyl-N-[2-methyl-5-(trifluoromethyl)phenyl]-3-[(4-pyridin-3-yl-5H-pyrrolo[3,2-d]pyrimidin-2-yl)methyl]benzamide
CID 157294126
7-[(2-Chloroimidazol-1-yl)methyl]-4-(4-fluorophenyl)quinoline-2-carboxamide;4-(4-fluorophenyl)-7-(imidazo[4,5-b]pyridin-3-ylmethyl)quinoline-2-carboxamide;4-(4-fluorophenyl)-7-[(2-methylimidazol-1-yl)methyl]quinoline-2-carboxamide;4-(4-fluorophenyl)-7-[(2-pyridin-3-ylbenzimidazol-1-yl)methyl]quinoline-2-carboxamide;4-(4-fluorophenyl)-7-[[2-(2,2,2-trifluoroethyl)benzimidazol-1-yl]methyl]quinoline-2-carboxamide
CID 157319707
N-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-4-hexylbenzamide;2,3-dichloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-(3-methylbutyl)benzamide;3-fluoro-N-methyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]-2-(trifluoromethyl)benzamide;N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]-3-(trifluoromethyl)benzamide
CID 157337754
2-methyl-N-(4-methylphenyl)-5-[3-(1H-pyrazol-5-yl)imidazo[1,5-a]pyridin-8-yl]benzamide;bis(N-(4-methylphenyl)-5-(3-pyridin-2-ylimidazo[1,5-a]pyridin-8-yl)-2-(trifluoromethyl)benzamide);N-(4-methylphenyl)-5-(3-pyrimidin-4-ylimidazo[1,5-a]pyridin-8-yl)-2-(trifluoromethyl)benzamide
CID 157377466
(6-chloro-2-methylimidazo[1,2-b]pyridazin-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;imidazo[1,2-b]pyridazin-6-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;1H-indol-3-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone
CID 157421955
[7-(5-chloro-1H-indole-2-carbonyl)-2,7-diazaspiro[3.5]nonan-2-yl]-[4-(1H-1,2,4-triazol-5-yl)phenyl]methanone;(5-chloro-1H-indol-2-yl)-[2-[[4-(1,1-difluoroethyl)-3-fluorophenyl]methyl]-2,7-diazaspiro[3.5]nonan-7-yl]methanone;(5-chloro-1H-indol-2-yl)-[2-[[4-(1,1-difluoroethyl)phenyl]methyl]-2,8-diazaspiro[4.5]decan-8-yl]methanone;(5-chloro-1H-indol-2-yl)-[2-[[4-(1,1-difluoroethyl)phenyl]methyl]-2,7-diazaspiro[3.5]nonan-7-yl]methanone;(5-chloro-1H-indol-2-yl)-[2-[(4-methylphenyl)methyl]-2,7-diazaspiro[3.5]nonan-7-yl]methanone
CID 157457941

Frequently Asked Questions

What is the IUPAC name of (5-chloro-1H-indol-2-yl)-(3-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone;[4-[[4-(1,1-difluoroethyl)-3-fluorophenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[(2-fluoro-4-methylphenyl)methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone?
The IUPAC name of (5-chloro-1H-indol-2-yl)-(3-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone;[4-[[4-(1,1-difluoroethyl)-3-fluorophenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[(2-fluoro-4-methylphenyl)methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone (CID 159761873) is (5-chloro-1H-indol-2-yl)-(3-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone;[4-[[4-(1,1-difluoroethyl)-3-fluorophenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[(2-fluoro-4-methylphenyl)methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone.
What is the SMILES notation for (5-chloro-1H-indol-2-yl)-(3-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone;[4-[[4-(1,1-difluoroethyl)-3-fluorophenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[(2-fluoro-4-methylphenyl)methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone?
The canonical SMILES for (5-chloro-1H-indol-2-yl)-(3-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone;[4-[[4-(1,1-difluoroethyl)-3-fluorophenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[(2-fluoro-4-methylphenyl)methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone is CC(F)(F)c1ccc(CN2CCN(C(=O)c3cc4cc(C(F)(F)F)ccc4[nH]3)CC2)cc1F.Cc1ccc(CN2CCN(C(=O)c3cc4cc(C(F)(F)F)ccc4[nH]3)CC2)c(C(F)(F)F)c1.Cc1ccc(CN2CCN(C(=O)c3cc4cc(C(F)(F)F)ccc4[nH]3)CC2)c(F)c1.Cc1ccc(CN2CCN(C(=O)c3cc4cc(C(F)(F)F)ccc4[nH]3)CC2)cc1C(F)(F)F.O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCn2c(-c3ccccc3)cnc2C1.
What is the InChIKey of (5-chloro-1H-indol-2-yl)-(3-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone;[4-[[4-(1,1-difluoroethyl)-3-fluorophenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[(2-fluoro-4-methylphenyl)methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone?
The InChIKey is NEZNJBLAVNBBIG-UHFFFAOYSA-N. The full InChI is InChI=1S/3C23H21F6N3O.C22H21F4N3O.C21H17ClN4O/c1-22(25,26)17-4-2-14(10-18(17)24)13-31-6-8-32(9-7-31)21(33)20-12-15-11-16(23(27,28)29)3-5-19(15)30-20;1-14-2-3-15(10-18(14)23(27,28)29)13-31-6-8-32(9-7-31)21(33)20-12-16-11-17(22(24,25)26)4-5-19(16)30-20;1-14-2-3-15(18(10-14)23(27,28)29)13-31-6-8-32(9-7-31)21(33)20-12-16-11-17(22(24,25)26)4-5-19(16)30-20;1-14-2-3-15(18(23)10-14)13-28-6-8-29(9-7-28)21(30)20-12-16-11-17(22(24,25)26)4-5-19(16)27-20;22-16-6-7-17-15(10-16)11-18(24-17)21(27)25-8-9-26-19(12-23-20(26)13-25)14-4-2-1-3-5-14/h3*2-5,10-12,30H,6-9,13H2,1H3;2-5,10-12,27H,6-9,13H2,1H3;1-7,10-12,24H,8-9,13H2.
What are the key properties of (5-chloro-1H-indol-2-yl)-(3-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone;[4-[[4-(1,1-difluoroethyl)-3-fluorophenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[(2-fluoro-4-methylphenyl)methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone?
(5-chloro-1H-indol-2-yl)-(3-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone;[4-[[4-(1,1-difluoroethyl)-3-fluorophenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[(2-fluoro-4-methylphenyl)methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone has a molecular weight of 2204.56 g/mol, XLogP of 25.27, 15 rotatable bonds, 5 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloro-1H-indol-2-yl)-(3-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone;[4-[[4-(1,1-difluoroethyl)-3-fluorophenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[(2-fluoro-4-methylphenyl)methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone is sourced from PubChem (CID 159761873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).