ethyl 4-[3-(4-chloro-3-nitro-1H-pyrazol-1-yl)propanoyl]piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[3-(4-chloro-3-nitro-1H-pyrazol-1-yl)propanoyl]piperazine-1-carboxylate
ethyl 4-[3-(4-chloro-3-nitro-1H-pyrazol-1-yl)propanoyl]piperazine-1-carboxylate
Compound characteristics
| Compound ID: | Y503-1656 |
| Compound Name: | ethyl 4-[3-(4-chloro-3-nitro-1H-pyrazol-1-yl)propanoyl]piperazine-1-carboxylate |
| Molecular Weight: | 359.77 |
| Molecular Formula: | C13 H18 Cl N5 O5 |
| Smiles: | CCOC(N1CCN(CC1)C(CCn1cc(c(n1)[N+]([O-])=O)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6867 |
| logD: | 0.6867 |
| logSw: | -1.9975 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 86.986 |
| InChI Key: | OBHCOHFVRAHLRQ-UHFFFAOYSA-N |