N-[(4-fluorophenyl)methyl]-2-[4-(furan-2-carbonyl)-1,4-diazepan-1-yl]-5-{[4-(trifluoromethyl)phenyl]carbamamido}benzamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-2-[4-(furan-2-carbonyl)-1,4-diazepan-1-yl]-5-{[4-(trifluoromethyl)phenyl]carbamamido}benzamide
N-[(4-fluorophenyl)methyl]-2-[4-(furan-2-carbonyl)-1,4-diazepan-1-yl]-5-{[4-(trifluoromethyl)phenyl]carbamamido}benzamide
Compound characteristics
| Compound ID: | V025-0832 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-2-[4-(furan-2-carbonyl)-1,4-diazepan-1-yl]-5-{[4-(trifluoromethyl)phenyl]carbamamido}benzamide |
| Molecular Weight: | 623.61 |
| Molecular Formula: | C32 H29 F4 N5 O4 |
| Salt: | not_available |
| Smiles: | C1CN(CCN(C1)c1ccc(cc1C(NCc1ccc(cc1)F)=O)NC(Nc1ccc(cc1)C(F)(F)F)=O)C(c1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0878 |
| logD: | 6.0876 |
| logSw: | -6.0174 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.472 |
| InChI Key: | OGWLLVNGCZOEIU-UHFFFAOYSA-N |