N-[(4-fluorophenyl)methyl]-2-[4-(furan-2-carbonyl)-1,4-diazepan-1-yl]-5-(2-methoxyacetamido)benzamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-2-[4-(furan-2-carbonyl)-1,4-diazepan-1-yl]-5-(2-methoxyacetamido)benzamide
N-[(4-fluorophenyl)methyl]-2-[4-(furan-2-carbonyl)-1,4-diazepan-1-yl]-5-(2-methoxyacetamido)benzamide
Compound characteristics
| Compound ID: | V005-2543 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-2-[4-(furan-2-carbonyl)-1,4-diazepan-1-yl]-5-(2-methoxyacetamido)benzamide |
| Molecular Weight: | 508.55 |
| Molecular Formula: | C27 H29 F N4 O5 |
| Salt: | not_available |
| Smiles: | COCC(Nc1ccc(c(c1)C(NCc1ccc(cc1)F)=O)N1CCCN(CC1)C(c1ccco1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8941 |
| logD: | 2.8939 |
| logSw: | -3.5077 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.742 |
| InChI Key: | YNBVVQFBGLLCDK-UHFFFAOYSA-N |