2-chloro-N-[4-(dimethylamino)-3-{[3,3-dimethyl-N-(2-methylpropyl)butanamido]methyl}phenyl]benzamide
Chemical Structure Depiction of
2-chloro-N-[4-(dimethylamino)-3-{[3,3-dimethyl-N-(2-methylpropyl)butanamido]methyl}phenyl]benzamide
2-chloro-N-[4-(dimethylamino)-3-{[3,3-dimethyl-N-(2-methylpropyl)butanamido]methyl}phenyl]benzamide
Compound characteristics
| Compound ID: | V013-0247 |
| Compound Name: | 2-chloro-N-[4-(dimethylamino)-3-{[3,3-dimethyl-N-(2-methylpropyl)butanamido]methyl}phenyl]benzamide |
| Molecular Weight: | 458.04 |
| Molecular Formula: | C26 H36 Cl N3 O2 |
| Salt: | not_available |
| Smiles: | CC(C)CN(Cc1cc(ccc1N(C)C)NC(c1ccccc1[Cl])=O)C(CC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2585 |
| logD: | 6.2554 |
| logSw: | -5.9338 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.789 |
| InChI Key: | NQWDKOXYCDRZGO-UHFFFAOYSA-N |