N-[(4-fluorophenyl)methyl]-2-[4-(4-methoxybenzoyl)-1,4-diazepan-1-yl]-5-(3-methylbutanamido)benzamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-2-[4-(4-methoxybenzoyl)-1,4-diazepan-1-yl]-5-(3-methylbutanamido)benzamide
N-[(4-fluorophenyl)methyl]-2-[4-(4-methoxybenzoyl)-1,4-diazepan-1-yl]-5-(3-methylbutanamido)benzamide
Compound characteristics
Compound ID: | V025-6137 |
Compound Name: | N-[(4-fluorophenyl)methyl]-2-[4-(4-methoxybenzoyl)-1,4-diazepan-1-yl]-5-(3-methylbutanamido)benzamide |
Molecular Weight: | 560.67 |
Molecular Formula: | C32 H37 F N4 O4 |
Salt: | not_available |
Smiles: | CC(C)CC(Nc1ccc(c(c1)C(NCc1ccc(cc1)F)=O)N1CCCN(CC1)C(c1ccc(cc1)OC)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.9282 |
logD: | 4.928 |
logSw: | -4.5548 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 75.284 |
InChI Key: | QENKRCLXMAUOAF-UHFFFAOYSA-N |