3-chloro-N-[5-chloro-2-[4-(4,4-dimethyl-2-oxopentyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chloro-3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;N-[5-chloro-2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]-4-methoxybenzamide;2-[1-[5-chloro-3-[2-(4-methylsulfonylphenyl)-2-oxoethyl]-2-pyridinyl]piperidin-4-yl]-1-(4-methyl-1,4-diazepan-1-yl)ethanone

C132H156Cl8N20O17S3 — CID 159173840

IUPAC3-chloro-N-[5-chloro-2-[4-(4,4-dimethyl-2-oxopentyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chloro-3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;N-[5-chloro-2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]-4-methoxybenzamide;2-[1-[5-chloro-3-[2-(4-methylsulfonylphenyl)-2-oxoethyl]-2-pyridinyl]piperidin-4-yl]-1-(4-methyl-1,4-diazepan-1-yl)ethanone
SMILESCC(C)(C)CC(=O)CC1CCN(c2ncc(Cl)cc2NC(=O)c2cccc(Cl)c2)CC1.CN1CCCN(C(=O)CC2CCN(c3ncc(Cl)cc3CC(=O)c3ccc(S(C)(=O)=O)cc3)CC2)CC1.COc1ccc(C(=O)Nc2cc(Cl)cnc2N2CCC(CC(=O)N3CCCN(C)CC3)CC2)cc1.CS(=O)(=O)c1cnc(N2CCC(CC(=O)NCc3ccccc3Cl)CC2)c(NC(=O)c2cccc(Cl)c2)c1.Cc1cccc(CNC(=O)CC2CCN(c3ncc(S(C)(=O)=O)cc3NC(=O)c3cccc(Cl)c3)CC2)c1Cl
InChIInChI=1S/C28H30Cl2N4O4S.C27H28Cl2N4O4S.C27H35ClN4O4S.C26H34ClN5O3.C24H29Cl2N3O2/c1-18-5-3-7-21(26(18)30)16-31-25(35)13-19-9-11-34(12-10-19)27-24(15-23(17-32-27)39(2,37)38)33-28(36)20-6-4-8-22(29)14-20;1-38(36,37)22-15-24(32-27(35)19-6-4-7-21(28)14-19)26(31-17-22)33-11-9-18(10-12-33)13-25(34)30-16-20-5-2-3-8-23(20)29;1-30-10-3-11-31(15-14-30)26(34)16-20-8-12-32(13-9-20)27-22(17-23(28)19-29-27)18-25(33)21-4-6-24(7-5-21)37(2,35)36;1-30-10-3-11-31(15-14-30)24(33)16-19-8-12-32(13-9-19)25-23(17-21(27)18-28-25)29-26(34)20-4-6-22(35-2)7-5-20;1-24(2,3)14-20(30)11-16-7-9-29(10-8-16)22-21(13-19(26)15-27-22)28-23(31)17-5-4-6-18(25)12-17/h3-8,14-15,17,19H,9-13,16H2,1-2H3,(H,31,35)(H,33,36);2-8,14-15,17-18H,9-13,16H2,1H3,(H,30,34)(H,32,35);4-7,17,19-20H,3,8-16,18H2,1-2H3;4-7,17-19H,3,8-16H2,1-2H3,(H,29,34);4-6,12-13,15-16H,7-11,14H2,1-3H3,(H,28,31)
InChIKeyKMAKVZIGFBAJFK-UHFFFAOYSA-N
MW2674.65 g/mol
LogP23.60
Rot. Bonds35

About 3-chloro-N-[5-chloro-2-[4-(4,4-dimethyl-2-oxopentyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chloro-3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;N-[5-chloro-2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]-4-methoxybenzamide;2-[1-[5-chloro-3-[2-(4-methylsulfonylphenyl)-2-oxoethyl]-2-pyridinyl]piperidin-4-yl]-1-(4-methyl-1,4-diazepan-1-yl)ethanone

3-chloro-N-[5-chloro-2-[4-(4,4-dimethyl-2-oxopentyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chloro-3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;N-[5-chloro-2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]-4-methoxybenzamide;2-[1-[5-chloro-3-[2-(4-methylsulfonylphenyl)-2-oxoethyl]-2-pyridinyl]piperidin-4-yl]-1-(4-methyl-1,4-diazepan-1-yl)ethanone (PubChem CID 159173840) has the molecular formula C132H156Cl8N20O17S3 and a molecular weight of 2674.65 g/mol. Its IUPAC name is 3-chloro-N-[5-chloro-2-[4-(4,4-dimethyl-2-oxopentyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chloro-3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;N-[5-chloro-2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]-4-methoxybenzamide;2-[1-[5-chloro-3-[2-(4-methylsulfonylphenyl)-2-oxoethyl]-2-pyridinyl]piperidin-4-yl]-1-(4-methyl-1,4-diazepan-1-yl)ethanone.

Molecular Properties

Compound Name3-chloro-N-[5-chloro-2-[4-(4,4-dimethyl-2-oxopentyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chloro-3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;N-[5-chloro-2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]-4-methoxybenzamide;2-[1-[5-chloro-3-[2-(4-methylsulfonylphenyl)-2-oxoethyl]-2-pyridinyl]piperidin-4-yl]-1-(4-methyl-1,4-diazepan-1-yl)ethanone
PubChem CID159173840
Molecular FormulaC132H156Cl8N20O17S3
Molecular Weight2674.65 g/mol
Exact Mass2668.86
IUPAC Name3-chloro-N-[5-chloro-2-[4-(4,4-dimethyl-2-oxopentyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chloro-3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;N-[5-chloro-2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]-4-methoxybenzamide;2-[1-[5-chloro-3-[2-(4-methylsulfonylphenyl)-2-oxoethyl]-2-pyridinyl]piperidin-4-yl]-1-(4-methyl-1,4-diazepan-1-yl)ethanone
SMILESCC(C)(C)CC(=O)CC1CCN(c2ncc(Cl)cc2NC(=O)c2cccc(Cl)c2)CC1.CN1CCCN(C(=O)CC2CCN(c3ncc(Cl)cc3CC(=O)c3ccc(S(C)(=O)=O)cc3)CC2)CC1.COc1ccc(C(=O)Nc2cc(Cl)cnc2N2CCC(CC(=O)N3CCCN(C)CC3)CC2)cc1.CS(=O)(=O)c1cnc(N2CCC(CC(=O)NCc3ccccc3Cl)CC2)c(NC(=O)c2cccc(Cl)c2)c1.Cc1cccc(CNC(=O)CC2CCN(c3ncc(S(C)(=O)=O)cc3NC(=O)c3cccc(Cl)c3)CC2)c1Cl
InChIInChI=1S/C28H30Cl2N4O4S.C27H28Cl2N4O4S.C27H35ClN4O4S.C26H34ClN5O3.C24H29Cl2N3O2/c1-18-5-3-7-21(26(18)30)16-31-25(35)13-19-9-11-34(12-10-19)27-24(15-23(17-32-27)39(2,37)38)33-28(36)20-6-4-8-22(29)14-20;1-38(36,37)22-15-24(32-27(35)19-6-4-7-21(28)14-19)26(31-17-22)33-11-9-18(10-12-33)13-25(34)30-16-20-5-2-3-8-23(20)29;1-30-10-3-11-31(15-14-30)26(34)16-20-8-12-32(13-9-20)27-22(17-23(28)19-29-27)18-25(33)21-4-6-24(7-5-21)37(2,35)36;1-30-10-3-11-31(15-14-30)24(33)16-19-8-12-32(13-9-19)25-23(17-21(27)18-28-25)29-26(34)20-4-6-22(35-2)7-5-20;1-24(2,3)14-20(30)11-16-7-9-29(10-8-16)22-21(13-19(26)15-27-22)28-23(31)17-5-4-6-18(25)12-17/h3-8,14-15,17,19H,9-13,16H2,1-2H3,(H,31,35)(H,33,36);2-8,14-15,17-18H,9-13,16H2,1H3,(H,30,34)(H,32,35);4-7,17,19-20H,3,8-16,18H2,1-2H3;4-7,17-19H,3,8-16H2,1-2H3,(H,29,34);4-6,12-13,15-16H,7-11,14H2,1-3H3,(H,28,31)
InChIKeyKMAKVZIGFBAJFK-UHFFFAOYSA-N
XLogP23.60
TPSA448.14 Ų
H-Bond Donors6
H-Bond Acceptors29
Rotatable Bonds35
Heavy Atoms180
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002674.65
LogP ≤ 523.60
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1029

Analyze 3-chloro-N-[5-chloro-2-[4-(4,4-dimethyl-2-oxopentyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chloro-3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;N-[5-chloro-2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]-4-methoxybenzamide;2-[1-[5-chloro-3-[2-(4-methylsulfonylphenyl)-2-oxoethyl]-2-pyridinyl]piperidin-4-yl]-1-(4-methyl-1,4-diazepan-1-yl)ethanone with MolForge

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Related Compounds

N-[2-[4-[2-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]-3-chlorobenzamide;5-[(3-chlorobenzoyl)amino]-N-cyclopropyl-6-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]pyridine-3-carboxamide;3-chloro-N-[2-[4-[2-[4-(1,1-difluoroethyl)piperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;2-[1-[3-[2-(4-methoxyphenyl)-2-oxoethyl]-5-methylsulfonyl-2-pyridinyl]piperidin-4-yl]-1-(4-methyl-1,4-diazepan-1-yl)ethanone
CID 158481773
3-chloro-N-[2-[4-[2-(2,6-dimethylanilino)-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide
CID 87355894
3-chloro-N-[5-chloro-2-[4-[2-(4-methoxypiperidin-1-yl)ethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[(4-methylpiperidin-1-yl)methyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-(cyclohexylmethylamino)-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[[1-(3-methoxyphenyl)cyclopropyl]amino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide
CID 157677189
2-[[4-(4-aminobutoxy)benzoyl]amino]-5-methyl-N-pyridin-2-ylbenzamide;2-[[2-(7-aminoheptylamino)-4-methylsulfonylbenzoyl]amino]-N-(5-chloro-2-pyridinyl)-5-methylbenzamide;2-[[4-(6-aminohexanoyl)benzoyl]amino]-5-methyl-N-pyridin-2-ylbenzamide;2-[[4-(8-aminooctanoyl)benzoyl]amino]-5-methyl-N-pyridin-2-ylbenzamide;2-[[4-(5-aminopentanoyl)benzoyl]amino]-5-methyl-N-pyridin-2-ylbenzamide
CID 159032496
3-chloro-N-[5-chloro-2-[4-[2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(3-methoxyphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide
CID 159105884

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-[5-chloro-2-[4-(4,4-dimethyl-2-oxopentyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chloro-3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;N-[5-chloro-2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]-4-methoxybenzamide;2-[1-[5-chloro-3-[2-(4-methylsulfonylphenyl)-2-oxoethyl]-2-pyridinyl]piperidin-4-yl]-1-(4-methyl-1,4-diazepan-1-yl)ethanone?
The IUPAC name of 3-chloro-N-[5-chloro-2-[4-(4,4-dimethyl-2-oxopentyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chloro-3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;N-[5-chloro-2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]-4-methoxybenzamide;2-[1-[5-chloro-3-[2-(4-methylsulfonylphenyl)-2-oxoethyl]-2-pyridinyl]piperidin-4-yl]-1-(4-methyl-1,4-diazepan-1-yl)ethanone (CID 159173840) is 3-chloro-N-[5-chloro-2-[4-(4,4-dimethyl-2-oxopentyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chloro-3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;N-[5-chloro-2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]-4-methoxybenzamide;2-[1-[5-chloro-3-[2-(4-methylsulfonylphenyl)-2-oxoethyl]-2-pyridinyl]piperidin-4-yl]-1-(4-methyl-1,4-diazepan-1-yl)ethanone.
What is the SMILES notation for 3-chloro-N-[5-chloro-2-[4-(4,4-dimethyl-2-oxopentyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chloro-3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;N-[5-chloro-2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]-4-methoxybenzamide;2-[1-[5-chloro-3-[2-(4-methylsulfonylphenyl)-2-oxoethyl]-2-pyridinyl]piperidin-4-yl]-1-(4-methyl-1,4-diazepan-1-yl)ethanone?
The canonical SMILES for 3-chloro-N-[5-chloro-2-[4-(4,4-dimethyl-2-oxopentyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chloro-3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;N-[5-chloro-2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]-4-methoxybenzamide;2-[1-[5-chloro-3-[2-(4-methylsulfonylphenyl)-2-oxoethyl]-2-pyridinyl]piperidin-4-yl]-1-(4-methyl-1,4-diazepan-1-yl)ethanone is CC(C)(C)CC(=O)CC1CCN(c2ncc(Cl)cc2NC(=O)c2cccc(Cl)c2)CC1.CN1CCCN(C(=O)CC2CCN(c3ncc(Cl)cc3CC(=O)c3ccc(S(C)(=O)=O)cc3)CC2)CC1.COc1ccc(C(=O)Nc2cc(Cl)cnc2N2CCC(CC(=O)N3CCCN(C)CC3)CC2)cc1.CS(=O)(=O)c1cnc(N2CCC(CC(=O)NCc3ccccc3Cl)CC2)c(NC(=O)c2cccc(Cl)c2)c1.Cc1cccc(CNC(=O)CC2CCN(c3ncc(S(C)(=O)=O)cc3NC(=O)c3cccc(Cl)c3)CC2)c1Cl.
What is the InChIKey of 3-chloro-N-[5-chloro-2-[4-(4,4-dimethyl-2-oxopentyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chloro-3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;N-[5-chloro-2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]-4-methoxybenzamide;2-[1-[5-chloro-3-[2-(4-methylsulfonylphenyl)-2-oxoethyl]-2-pyridinyl]piperidin-4-yl]-1-(4-methyl-1,4-diazepan-1-yl)ethanone?
The InChIKey is KMAKVZIGFBAJFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H30Cl2N4O4S.C27H28Cl2N4O4S.C27H35ClN4O4S.C26H34ClN5O3.C24H29Cl2N3O2/c1-18-5-3-7-21(26(18)30)16-31-25(35)13-19-9-11-34(12-10-19)27-24(15-23(17-32-27)39(2,37)38)33-28(36)20-6-4-8-22(29)14-20;1-38(36,37)22-15-24(32-27(35)19-6-4-7-21(28)14-19)26(31-17-22)33-11-9-18(10-12-33)13-25(34)30-16-20-5-2-3-8-23(20)29;1-30-10-3-11-31(15-14-30)26(34)16-20-8-12-32(13-9-20)27-22(17-23(28)19-29-27)18-25(33)21-4-6-24(7-5-21)37(2,35)36;1-30-10-3-11-31(15-14-30)24(33)16-19-8-12-32(13-9-19)25-23(17-21(27)18-28-25)29-26(34)20-4-6-22(35-2)7-5-20;1-24(2,3)14-20(30)11-16-7-9-29(10-8-16)22-21(13-19(26)15-27-22)28-23(31)17-5-4-6-18(25)12-17/h3-8,14-15,17,19H,9-13,16H2,1-2H3,(H,31,35)(H,33,36);2-8,14-15,17-18H,9-13,16H2,1H3,(H,30,34)(H,32,35);4-7,17,19-20H,3,8-16,18H2,1-2H3;4-7,17-19H,3,8-16H2,1-2H3,(H,29,34);4-6,12-13,15-16H,7-11,14H2,1-3H3,(H,28,31).
What are the key properties of 3-chloro-N-[5-chloro-2-[4-(4,4-dimethyl-2-oxopentyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chloro-3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;N-[5-chloro-2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]-4-methoxybenzamide;2-[1-[5-chloro-3-[2-(4-methylsulfonylphenyl)-2-oxoethyl]-2-pyridinyl]piperidin-4-yl]-1-(4-methyl-1,4-diazepan-1-yl)ethanone?
3-chloro-N-[5-chloro-2-[4-(4,4-dimethyl-2-oxopentyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chloro-3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;N-[5-chloro-2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]-4-methoxybenzamide;2-[1-[5-chloro-3-[2-(4-methylsulfonylphenyl)-2-oxoethyl]-2-pyridinyl]piperidin-4-yl]-1-(4-methyl-1,4-diazepan-1-yl)ethanone has a molecular weight of 2674.65 g/mol, XLogP of 23.60, 35 rotatable bonds, 6 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-[5-chloro-2-[4-(4,4-dimethyl-2-oxopentyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chloro-3-methylphenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;N-[5-chloro-2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]-4-methoxybenzamide;2-[1-[5-chloro-3-[2-(4-methylsulfonylphenyl)-2-oxoethyl]-2-pyridinyl]piperidin-4-yl]-1-(4-methyl-1,4-diazepan-1-yl)ethanone is sourced from PubChem (CID 159173840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).