N-(adamantan-1-yl)-4-[(4-chlorophenyl)sulfanyl]-3-nitrobenzamide
Chemical Structure Depiction of
N-(adamantan-1-yl)-4-[(4-chlorophenyl)sulfanyl]-3-nitrobenzamide
N-(adamantan-1-yl)-4-[(4-chlorophenyl)sulfanyl]-3-nitrobenzamide
Compound characteristics
| Compound ID: | 8015-4686 |
| Compound Name: | N-(adamantan-1-yl)-4-[(4-chlorophenyl)sulfanyl]-3-nitrobenzamide |
| Molecular Weight: | 442.96 |
| Molecular Formula: | C23 H23 Cl N2 O3 S |
| Smiles: | C1C2CC3CC1CC(C2)(C3)NC(c1ccc(c(c1)[N+]([O-])=O)Sc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.7471 |
| logD: | 6.7471 |
| logSw: | -6.6161 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.156 |
| InChI Key: | OGZHWYVGMLMGBY-UHFFFAOYSA-N |