6-[(2,6-dichlorophenyl)sulfanylmethyl]-N-[2-(2,4-dimethylphenyl)ethyl]pyridine-2-carboxamide;1-[4-[6-[(2,6-dichlorophenyl)sulfanylmethyl]pyridine-2-carbonyl]-1,4-diazepan-1-yl]ethanone;[6-[(2,6-dichlorophenyl)sulfanylmethyl]-2-pyridinyl]-[4-(1-methoxyethenyl)piperidin-1-yl]methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(3-methylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone
C149H171Cl6N15O9S7 — CID 158864424
Data last refreshed: (MolForge compound catalog, from PubChem)
IUPAC6-[(2,6-dichlorophenyl)sulfanylmethyl]-N-[2-(2,4-dimethylphenyl)ethyl]pyridine-2-carboxamide;1-[4-[6-[(2,6-dichlorophenyl)sulfanylmethyl]pyridine-2-carbonyl]-1,4-diazepan-1-yl]ethanone;[6-[(2,6-dichlorophenyl)sulfanylmethyl]-2-pyridinyl]-[4-(1-methoxyethenyl)piperidin-1-yl]methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(3-methylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone
SMILESC=C(OC)C1CCN(C(=O)c2cccc(CSc3c(Cl)cccc3Cl)n2)CC1.CC(=O)N1CCCN(C(=O)c2cccc(CSc3c(Cl)cccc3Cl)n2)CC1.CCC1CCCCN1C(=O)c1cccc(CSc2ccc(C)cc2C)n1.Cc1ccc(CCNC(=O)c2cccc(CSc3c(Cl)cccc3Cl)n2)c(C)c1.Cc1ccc(SCc2cccc(C(=O)N3C(C)CCCC3C)n2)c(C)c1.Cc1ccc(SCc2cccc(C(=O)N3CCCC(C)C3)n2)c(C)c1.Cc1ccc(SCc2cccc(C(=O)N3CCCCC3)n2)c(C)c1
InChIInChI=1S/C23H22Cl2N2OS.2C22H28N2OS.C21H22Cl2N2O2S.C21H26N2OS.C20H21Cl2N3O2S.C20H24N2OS/c1-15-9-10-17(16(2)13-15)11-12-26-23(28)21-8-3-5-18(27-21)14-29-22-19(24)6-4-7-20(22)25;1-15-11-12-21(16(2)13-15)26-14-19-9-6-10-20(23-19)22(25)24-17(3)7-5-8-18(24)4;1-4-19-9-5-6-13-24(19)22(25)20-10-7-8-18(23-20)15-26-21-12-11-16(2)14-17(21)3;1-14(27-2)15-9-11-25(12-10-15)21(26)19-8-3-5-16(24-19)13-28-20-17(22)6-4-7-18(20)23;1-15-9-10-20(17(3)12-15)25-14-18-7-4-8-19(22-18)21(24)23-11-5-6-16(2)13-23;1-14(26)24-9-4-10-25(12-11-24)20(27)18-8-2-5-15(23-18)13-28-19-16(21)6-3-7-17(19)22;1-15-9-10-19(16(2)13-15)24-14-17-7-6-8-18(21-17)20(23)22-11-4-3-5-12-22/h3-10,13H,11-12,14H2,1-2H3,(H,26,28);6,9-13,17-18H,5,7-8,14H2,1-4H3;7-8,10-12,14,19H,4-6,9,13,15H2,1-3H3;3-8,15H,1,9-13H2,2H3;4,7-10,12,16H,5-6,11,13-14H2,1-3H3;2-3,5-8H,4,9-13H2,1H3;6-10,13H,3-5,11-12,14H2,1-2H3
InChIKeyJBAZMUXLYPRTHK-UHFFFAOYSA-N
MW2753.29 g/mol
LogP36.61
Rot. Bonds34
About 6-[(2,6-dichlorophenyl)sulfanylmethyl]-N-[2-(2,4-dimethylphenyl)ethyl]pyridine-2-carboxamide;1-[4-[6-[(2,6-dichlorophenyl)sulfanylmethyl]pyridine-2-carbonyl]-1,4-diazepan-1-yl]ethanone;[6-[(2,6-dichlorophenyl)sulfanylmethyl]-2-pyridinyl]-[4-(1-methoxyethenyl)piperidin-1-yl]methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(3-methylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone
6-[(2,6-dichlorophenyl)sulfanylmethyl]-N-[2-(2,4-dimethylphenyl)ethyl]pyridine-2-carboxamide;1-[4-[6-[(2,6-dichlorophenyl)sulfanylmethyl]pyridine-2-carbonyl]-1,4-diazepan-1-yl]ethanone;[6-[(2,6-dichlorophenyl)sulfanylmethyl]-2-pyridinyl]-[4-(1-methoxyethenyl)piperidin-1-yl]methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(3-methylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone (PubChem CID 158864424) has the molecular formula C149H171Cl6N15O9S7 and a molecular weight of 2753.29 g/mol. Its IUPAC name is 6-[(2,6-dichlorophenyl)sulfanylmethyl]-N-[2-(2,4-dimethylphenyl)ethyl]pyridine-2-carboxamide;1-[4-[6-[(2,6-dichlorophenyl)sulfanylmethyl]pyridine-2-carbonyl]-1,4-diazepan-1-yl]ethanone;[6-[(2,6-dichlorophenyl)sulfanylmethyl]-2-pyridinyl]-[4-(1-methoxyethenyl)piperidin-1-yl]methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(3-methylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone.
Molecular Properties
| Compound Name | 6-[(2,6-dichlorophenyl)sulfanylmethyl]-N-[2-(2,4-dimethylphenyl)ethyl]pyridine-2-carboxamide;1-[4-[6-[(2,6-dichlorophenyl)sulfanylmethyl]pyridine-2-carbonyl]-1,4-diazepan-1-yl]ethanone;[6-[(2,6-dichlorophenyl)sulfanylmethyl]-2-pyridinyl]-[4-(1-methoxyethenyl)piperidin-1-yl]methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(3-methylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone |
|---|---|
| PubChem CID | 158864424 |
| Molecular Formula | C149H171Cl6N15O9S7 |
| Molecular Weight | 2753.29 g/mol |
| Exact Mass | 2747.96 |
| IUPAC Name | 6-[(2,6-dichlorophenyl)sulfanylmethyl]-N-[2-(2,4-dimethylphenyl)ethyl]pyridine-2-carboxamide;1-[4-[6-[(2,6-dichlorophenyl)sulfanylmethyl]pyridine-2-carbonyl]-1,4-diazepan-1-yl]ethanone;[6-[(2,6-dichlorophenyl)sulfanylmethyl]-2-pyridinyl]-[4-(1-methoxyethenyl)piperidin-1-yl]methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(3-methylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone |
| SMILES | C=C(OC)C1CCN(C(=O)c2cccc(CSc3c(Cl)cccc3Cl)n2)CC1.CC(=O)N1CCCN(C(=O)c2cccc(CSc3c(Cl)cccc3Cl)n2)CC1.CCC1CCCCN1C(=O)c1cccc(CSc2ccc(C)cc2C)n1.Cc1ccc(CCNC(=O)c2cccc(CSc3c(Cl)cccc3Cl)n2)c(C)c1.Cc1ccc(SCc2cccc(C(=O)N3C(C)CCCC3C)n2)c(C)c1.Cc1ccc(SCc2cccc(C(=O)N3CCCC(C)C3)n2)c(C)c1.Cc1ccc(SCc2cccc(C(=O)N3CCCCC3)n2)c(C)c1 |
| InChI | InChI=1S/C23H22Cl2N2OS.2C22H28N2OS.C21H22Cl2N2O2S.C21H26N2OS.C20H21Cl2N3O2S.C20H24N2OS/c1-15-9-10-17(16(2)13-15)11-12-26-23(28)21-8-3-5-18(27-21)14-29-22-19(24)6-4-7-20(22)25;1-15-11-12-21(16(2)13-15)26-14-19-9-6-10-20(23-19)22(25)24-17(3)7-5-8-18(24)4;1-4-19-9-5-6-13-24(19)22(25)20-10-7-8-18(23-20)15-26-21-12-11-16(2)14-17(21)3;1-14(27-2)15-9-11-25(12-10-15)21(26)19-8-3-5-16(24-19)13-28-20-17(22)6-4-7-18(20)23;1-15-9-10-20(17(3)12-15)25-14-18-7-4-8-19(22-18)21(24)23-11-5-6-16(2)13-23;1-14(26)24-9-4-10-25(12-11-24)20(27)18-8-2-5-15(23-18)13-28-19-16(21)6-3-7-17(19)22;1-15-9-10-19(16(2)13-15)24-14-17-7-6-8-18(21-17)20(23)22-11-4-3-5-12-22/h3-10,13H,11-12,14H2,1-2H3,(H,26,28);6,9-13,17-18H,5,7-8,14H2,1-4H3;7-8,10-12,14,19H,4-6,9,13,15H2,1-3H3;3-8,15H,1,9-13H2,2H3;4,7-10,12,16H,5-6,11,13-14H2,1-3H3;2-3,5-8H,4,9-13H2,1H3;6-10,13H,3-5,11-12,14H2,1-2H3 |
| InChIKey | JBAZMUXLYPRTHK-UHFFFAOYSA-N |
| XLogP | 36.61 |
| TPSA | 270.73 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 23 |
| Rotatable Bonds | 34 |
| Heavy Atoms | 186 |
| Complexity | — |
Lipinski Rule of Five
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2753.29 |
| LogP ≤ 5 | 36.61 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 23 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'} |
|---|
Frequently Asked Questions
What is the IUPAC name of 6-[(2,6-dichlorophenyl)sulfanylmethyl]-N-[2-(2,4-dimethylphenyl)ethyl]pyridine-2-carboxamide;1-[4-[6-[(2,6-dichlorophenyl)sulfanylmethyl]pyridine-2-carbonyl]-1,4-diazepan-1-yl]ethanone;[6-[(2,6-dichlorophenyl)sulfanylmethyl]-2-pyridinyl]-[4-(1-methoxyethenyl)piperidin-1-yl]methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(3-methylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone?
The IUPAC name of 6-[(2,6-dichlorophenyl)sulfanylmethyl]-N-[2-(2,4-dimethylphenyl)ethyl]pyridine-2-carboxamide;1-[4-[6-[(2,6-dichlorophenyl)sulfanylmethyl]pyridine-2-carbonyl]-1,4-diazepan-1-yl]ethanone;[6-[(2,6-dichlorophenyl)sulfanylmethyl]-2-pyridinyl]-[4-(1-methoxyethenyl)piperidin-1-yl]methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(3-methylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone (CID 158864424) is 6-[(2,6-dichlorophenyl)sulfanylmethyl]-N-[2-(2,4-dimethylphenyl)ethyl]pyridine-2-carboxamide;1-[4-[6-[(2,6-dichlorophenyl)sulfanylmethyl]pyridine-2-carbonyl]-1,4-diazepan-1-yl]ethanone;[6-[(2,6-dichlorophenyl)sulfanylmethyl]-2-pyridinyl]-[4-(1-methoxyethenyl)piperidin-1-yl]methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(3-methylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone.
What is the SMILES notation for 6-[(2,6-dichlorophenyl)sulfanylmethyl]-N-[2-(2,4-dimethylphenyl)ethyl]pyridine-2-carboxamide;1-[4-[6-[(2,6-dichlorophenyl)sulfanylmethyl]pyridine-2-carbonyl]-1,4-diazepan-1-yl]ethanone;[6-[(2,6-dichlorophenyl)sulfanylmethyl]-2-pyridinyl]-[4-(1-methoxyethenyl)piperidin-1-yl]methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(3-methylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone?
The canonical SMILES for 6-[(2,6-dichlorophenyl)sulfanylmethyl]-N-[2-(2,4-dimethylphenyl)ethyl]pyridine-2-carboxamide;1-[4-[6-[(2,6-dichlorophenyl)sulfanylmethyl]pyridine-2-carbonyl]-1,4-diazepan-1-yl]ethanone;[6-[(2,6-dichlorophenyl)sulfanylmethyl]-2-pyridinyl]-[4-(1-methoxyethenyl)piperidin-1-yl]methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(3-methylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone is C=C(OC)C1CCN(C(=O)c2cccc(CSc3c(Cl)cccc3Cl)n2)CC1.CC(=O)N1CCCN(C(=O)c2cccc(CSc3c(Cl)cccc3Cl)n2)CC1.CCC1CCCCN1C(=O)c1cccc(CSc2ccc(C)cc2C)n1.Cc1ccc(CCNC(=O)c2cccc(CSc3c(Cl)cccc3Cl)n2)c(C)c1.Cc1ccc(SCc2cccc(C(=O)N3C(C)CCCC3C)n2)c(C)c1.Cc1ccc(SCc2cccc(C(=O)N3CCCC(C)C3)n2)c(C)c1.Cc1ccc(SCc2cccc(C(=O)N3CCCCC3)n2)c(C)c1.
What is the InChIKey of 6-[(2,6-dichlorophenyl)sulfanylmethyl]-N-[2-(2,4-dimethylphenyl)ethyl]pyridine-2-carboxamide;1-[4-[6-[(2,6-dichlorophenyl)sulfanylmethyl]pyridine-2-carbonyl]-1,4-diazepan-1-yl]ethanone;[6-[(2,6-dichlorophenyl)sulfanylmethyl]-2-pyridinyl]-[4-(1-methoxyethenyl)piperidin-1-yl]methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(3-methylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone?
The InChIKey is JBAZMUXLYPRTHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22Cl2N2OS.2C22H28N2OS.C21H22Cl2N2O2S.C21H26N2OS.C20H21Cl2N3O2S.C20H24N2OS/c1-15-9-10-17(16(2)13-15)11-12-26-23(28)21-8-3-5-18(27-21)14-29-22-19(24)6-4-7-20(22)25;1-15-11-12-21(16(2)13-15)26-14-19-9-6-10-20(23-19)22(25)24-17(3)7-5-8-18(24)4;1-4-19-9-5-6-13-24(19)22(25)20-10-7-8-18(23-20)15-26-21-12-11-16(2)14-17(21)3;1-14(27-2)15-9-11-25(12-10-15)21(26)19-8-3-5-16(24-19)13-28-20-17(22)6-4-7-18(20)23;1-15-9-10-20(17(3)12-15)25-14-18-7-4-8-19(22-18)21(24)23-11-5-6-16(2)13-23;1-14(26)24-9-4-10-25(12-11-24)20(27)18-8-2-5-15(23-18)13-28-19-16(21)6-3-7-17(19)22;1-15-9-10-19(16(2)13-15)24-14-17-7-6-8-18(21-17)20(23)22-11-4-3-5-12-22/h3-10,13H,11-12,14H2,1-2H3,(H,26,28);6,9-13,17-18H,5,7-8,14H2,1-4H3;7-8,10-12,14,19H,4-6,9,13,15H2,1-3H3;3-8,15H,1,9-13H2,2H3;4,7-10,12,16H,5-6,11,13-14H2,1-3H3;2-3,5-8H,4,9-13H2,1H3;6-10,13H,3-5,11-12,14H2,1-2H3.
What are the key properties of 6-[(2,6-dichlorophenyl)sulfanylmethyl]-N-[2-(2,4-dimethylphenyl)ethyl]pyridine-2-carboxamide;1-[4-[6-[(2,6-dichlorophenyl)sulfanylmethyl]pyridine-2-carbonyl]-1,4-diazepan-1-yl]ethanone;[6-[(2,6-dichlorophenyl)sulfanylmethyl]-2-pyridinyl]-[4-(1-methoxyethenyl)piperidin-1-yl]methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(3-methylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone?
6-[(2,6-dichlorophenyl)sulfanylmethyl]-N-[2-(2,4-dimethylphenyl)ethyl]pyridine-2-carboxamide;1-[4-[6-[(2,6-dichlorophenyl)sulfanylmethyl]pyridine-2-carbonyl]-1,4-diazepan-1-yl]ethanone;[6-[(2,6-dichlorophenyl)sulfanylmethyl]-2-pyridinyl]-[4-(1-methoxyethenyl)piperidin-1-yl]methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(3-methylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone has a molecular weight of 2753.29 g/mol, XLogP of 36.61, 34 rotatable bonds, 1 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2,6-dichlorophenyl)sulfanylmethyl]-N-[2-(2,4-dimethylphenyl)ethyl]pyridine-2-carboxamide;1-[4-[6-[(2,6-dichlorophenyl)sulfanylmethyl]pyridine-2-carbonyl]-1,4-diazepan-1-yl]ethanone;[6-[(2,6-dichlorophenyl)sulfanylmethyl]-2-pyridinyl]-[4-(1-methoxyethenyl)piperidin-1-yl]methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(3-methylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone is sourced from PubChem (CID 158864424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).
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Sources
- PubChem CID 158864424 — identifiers, structure, computed properties (public domain)
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