N-[(4-fluorophenyl)methyl]-5-(2-methoxyacetamido)-2-[4-(3-methylbutanoyl)-1,4-diazepan-1-yl]benzamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-5-(2-methoxyacetamido)-2-[4-(3-methylbutanoyl)-1,4-diazepan-1-yl]benzamide
N-[(4-fluorophenyl)methyl]-5-(2-methoxyacetamido)-2-[4-(3-methylbutanoyl)-1,4-diazepan-1-yl]benzamide
Compound characteristics
| Compound ID: | V026-4167 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-5-(2-methoxyacetamido)-2-[4-(3-methylbutanoyl)-1,4-diazepan-1-yl]benzamide |
| Molecular Weight: | 498.6 |
| Molecular Formula: | C27 H35 F N4 O4 |
| Salt: | not_available |
| Smiles: | CC(C)CC(N1CCCN(CC1)c1ccc(cc1C(NCc1ccc(cc1)F)=O)NC(COC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4383 |
| logD: | 3.438 |
| logSw: | -3.8064 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.908 |
| InChI Key: | SPFHEFCHONKCDK-UHFFFAOYSA-N |