C133H208N18O24S6 — CID 158802984
N-butan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-tert-butyl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-[3-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;2,5-dimethyl-N-propan-2-yl-3-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;2,3,5-trimethyl-N-propan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide (PubChem CID 158802984) has the molecular formula C133H208N18O24S6 and a molecular weight of 2635.63 g/mol. Its IUPAC name is N-butan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-tert-butyl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-[3-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;2,5-dimethyl-N-propan-2-yl-3-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;2,3,5-trimethyl-N-propan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide.
| Compound Name | N-butan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-tert-butyl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-[3-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;2,5-dimethyl-N-propan-2-yl-3-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;2,3,5-trimethyl-N-propan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide |
|---|---|
| PubChem CID | 158802984 |
| Molecular Formula | C133H208N18O24S6 |
| Molecular Weight | 2635.63 g/mol |
| Exact Mass | 2633.39 |
| IUPAC Name | N-butan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-tert-butyl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-[3-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;2,5-dimethyl-N-propan-2-yl-3-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;2,3,5-trimethyl-N-propan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide |
| SMILES | CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(NC(=O)C3CCCCC3)cc2)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2cccc(NC(=O)C3CCCCC3)c2)CC1.CCC(C)NC(=O)c1ccc(NC(=O)C2CCC(NS(=O)(=O)C(C)C)CC2)cc1.Cc1cc(C(=O)NC(C)C)c(C)c(C)c1NC(=O)C1CCC(NS(=O)(=O)C(C)C)CC1.Cc1cc(NC(=O)C2CCC(NS(=O)(=O)C(C)C)CC2)c(C)c(C(=O)NC(C)C)c1 |
| InChI | InChI=1S/2C23H35N3O4S.C23H37N3O4S.C22H35N3O4S.2C21H33N3O4S/c1-16(2)31(29,30)26-19-13-11-18(12-14-19)23(28)25-21-10-6-9-20(15-21)24-22(27)17-7-4-3-5-8-17;1-16(2)31(29,30)26-21-10-8-18(9-11-21)23(28)25-20-14-12-19(13-15-20)24-22(27)17-6-4-3-5-7-17;1-13(2)24-23(28)20-12-15(5)21(17(7)16(20)6)25-22(27)18-8-10-19(11-9-18)26-31(29,30)14(3)4;1-13(2)23-22(27)19-11-15(5)12-20(16(19)6)24-21(26)17-7-9-18(10-8-17)25-30(28,29)14(3)4;1-14(2)29(27,28)24-18-12-8-15(9-13-18)19(25)22-17-10-6-16(7-11-17)20(26)23-21(3,4)5;1-5-15(4)22-20(25)16-6-10-18(11-7-16)23-21(26)17-8-12-19(13-9-17)24-29(27,28)14(2)3/h6,9-10,15-19,26H,3-5,7-8,11-14H2,1-2H3,(H,24,27)(H,25,28);12-18,21,26H,3-11H2,1-2H3,(H,24,27)(H,25,28);12-14,18-19,26H,8-11H2,1-7H3,(H,24,28)(H,25,27);11-14,17-18,25H,7-10H2,1-6H3,(H,23,27)(H,24,26);6-7,10-11,14-15,18,24H,8-9,12-13H2,1-5H3,(H,22,25)(H,23,26);6-7,10-11,14-15,17,19,24H,5,8-9,12-13H2,1-4H3,(H,22,25)(H,23,26) |
| InChIKey | ITSLBEISNSGZFO-UHFFFAOYSA-N |
| XLogP | 20.98 |
| TPSA | 626.22 Ų |
| H-Bond Donors | 18 |
| H-Bond Acceptors | 24 |
| Rotatable Bonds | 42 |
| Heavy Atoms | 181 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2635.63 |
| LogP ≤ 5 | 20.98 |
| H-Bond Donors ≤ 5 | 18 |
| H-Bond Acceptors ≤ 10 | 24 |