N-(adamantan-1-yl)-4-(4-chloro-2-nitrophenyl)piperazine-1-carboxamide
Chemical Structure Depiction of
N-(adamantan-1-yl)-4-(4-chloro-2-nitrophenyl)piperazine-1-carboxamide
N-(adamantan-1-yl)-4-(4-chloro-2-nitrophenyl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | 8017-4308 |
| Compound Name: | N-(adamantan-1-yl)-4-(4-chloro-2-nitrophenyl)piperazine-1-carboxamide |
| Molecular Weight: | 418.92 |
| Molecular Formula: | C21 H27 Cl N4 O3 |
| Smiles: | C1C2CC3CC1CC(C2)(C3)NC(N1CCN(CC1)c1ccc(cc1[N+]([O-])=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.6172 |
| logD: | 4.6171 |
| logSw: | -4.8528 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.765 |
| InChI Key: | ARQJRAATBWWKNZ-UHFFFAOYSA-N |