4-[(5-chlorothiophen-2-yl)methyl]-N-(2-nitrophenyl)piperazine-1-carboxamide
Chemical Structure Depiction of
4-[(5-chlorothiophen-2-yl)methyl]-N-(2-nitrophenyl)piperazine-1-carboxamide
4-[(5-chlorothiophen-2-yl)methyl]-N-(2-nitrophenyl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | Y206-6847 |
| Compound Name: | 4-[(5-chlorothiophen-2-yl)methyl]-N-(2-nitrophenyl)piperazine-1-carboxamide |
| Molecular Weight: | 380.85 |
| Molecular Formula: | C16 H17 Cl N4 O3 S |
| Smiles: | C1CN(CCN1Cc1ccc(s1)[Cl])C(Nc1ccccc1[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4228 |
| logD: | 3.3923 |
| logSw: | -3.7784 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.649 |
| InChI Key: | CHQHCXVBEHRBRP-UHFFFAOYSA-N |