4-[2-{[(4-fluorophenyl)methyl]carbamoyl}-4-(2-methoxyacetamido)phenyl]-N-(4-methoxyphenyl)-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
4-[2-{[(4-fluorophenyl)methyl]carbamoyl}-4-(2-methoxyacetamido)phenyl]-N-(4-methoxyphenyl)-1,4-diazepane-1-carboxamide
4-[2-{[(4-fluorophenyl)methyl]carbamoyl}-4-(2-methoxyacetamido)phenyl]-N-(4-methoxyphenyl)-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | V024-9516 |
| Compound Name: | 4-[2-{[(4-fluorophenyl)methyl]carbamoyl}-4-(2-methoxyacetamido)phenyl]-N-(4-methoxyphenyl)-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 563.63 |
| Molecular Formula: | C30 H34 F N5 O5 |
| Salt: | not_available |
| Smiles: | COCC(Nc1ccc(c(c1)C(NCc1ccc(cc1)F)=O)N1CCCN(CC1)C(Nc1ccc(cc1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8199 |
| logD: | 3.8179 |
| logSw: | -4.052 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 92.528 |
| InChI Key: | WTHFJISWMIGDRG-UHFFFAOYSA-N |