[4-(adamantan-1-yl)piperazin-1-yl](2-chloro-5-nitrophenyl)methanone
Chemical Structure Depiction of
[4-(adamantan-1-yl)piperazin-1-yl](2-chloro-5-nitrophenyl)methanone
[4-(adamantan-1-yl)piperazin-1-yl](2-chloro-5-nitrophenyl)methanone
Compound characteristics
| Compound ID: | 8012-5397 |
| Compound Name: | [4-(adamantan-1-yl)piperazin-1-yl](2-chloro-5-nitrophenyl)methanone |
| Molecular Weight: | 403.91 |
| Molecular Formula: | C21 H26 Cl N3 O3 |
| Smiles: | C1C2CC3CC1CC(C2)(C3)N1CCN(CC1)C(c1cc(ccc1[Cl])[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5885 |
| logD: | 4.5482 |
| logSw: | -4.8528 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.22 |
| InChI Key: | CYXZSDMOMRXCPF-UHFFFAOYSA-N |