N-[(4-fluorophenyl)methyl]-5-[(4-methylbenzene-1-sulfonyl)amino]-2-[4-(3-methylbutanoyl)-1,4-diazepan-1-yl]benzamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-5-[(4-methylbenzene-1-sulfonyl)amino]-2-[4-(3-methylbutanoyl)-1,4-diazepan-1-yl]benzamide
N-[(4-fluorophenyl)methyl]-5-[(4-methylbenzene-1-sulfonyl)amino]-2-[4-(3-methylbutanoyl)-1,4-diazepan-1-yl]benzamide
Compound characteristics
| Compound ID: | V025-6172 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-5-[(4-methylbenzene-1-sulfonyl)amino]-2-[4-(3-methylbutanoyl)-1,4-diazepan-1-yl]benzamide |
| Molecular Weight: | 580.72 |
| Molecular Formula: | C31 H37 F N4 O4 S |
| Salt: | not_available |
| Smiles: | CC(C)CC(N1CCCN(CC1)c1ccc(cc1C(NCc1ccc(cc1)F)=O)NS(c1ccc(C)cc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4442 |
| logD: | 5.3865 |
| logSw: | -5.356 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.984 |
| InChI Key: | RBHCUTOFLHULQZ-UHFFFAOYSA-N |