4-butanamido-N-(2-chloro-4-nitrophenyl)benzamide
Chemical Structure Depiction of
4-butanamido-N-(2-chloro-4-nitrophenyl)benzamide
4-butanamido-N-(2-chloro-4-nitrophenyl)benzamide
Compound characteristics
Compound ID: | Y032-3456 |
Compound Name: | 4-butanamido-N-(2-chloro-4-nitrophenyl)benzamide |
Molecular Weight: | 361.78 |
Molecular Formula: | C17 H16 Cl N3 O4 |
Smiles: | CCCC(Nc1ccc(cc1)C(Nc1ccc(cc1[Cl])[N+]([O-])=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.6476 |
logD: | 2.415 |
logSw: | -4.1284 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 79.163 |
InChI Key: | FDKKVOUXMYDMMN-UHFFFAOYSA-N |