N-[(4-fluorophenyl)methyl]-5-(4-methylbenzamido)-2-[4-(4-methylbenzoyl)-1,4-diazepan-1-yl]benzamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-5-(4-methylbenzamido)-2-[4-(4-methylbenzoyl)-1,4-diazepan-1-yl]benzamide
N-[(4-fluorophenyl)methyl]-5-(4-methylbenzamido)-2-[4-(4-methylbenzoyl)-1,4-diazepan-1-yl]benzamide
Compound characteristics
| Compound ID: | V025-6170 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-5-(4-methylbenzamido)-2-[4-(4-methylbenzoyl)-1,4-diazepan-1-yl]benzamide |
| Molecular Weight: | 578.69 |
| Molecular Formula: | C35 H35 F N4 O3 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)C(Nc1ccc(c(c1)C(NCc1ccc(cc1)F)=O)N1CCCN(CC1)C(c1ccc(C)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9944 |
| logD: | 5.9941 |
| logSw: | -5.4404 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.682 |
| InChI Key: | CROQNNVZTNASAE-UHFFFAOYSA-N |