2-(4-{4-nitro-3-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]phenyl}piperazin-1-yl)ethan-1-ol
Chemical Structure Depiction of
2-(4-{4-nitro-3-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]phenyl}piperazin-1-yl)ethan-1-ol
2-(4-{4-nitro-3-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]phenyl}piperazin-1-yl)ethan-1-ol
Compound characteristics
| Compound ID: | 8014-6508 |
| Compound Name: | 2-(4-{4-nitro-3-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]phenyl}piperazin-1-yl)ethan-1-ol |
| Molecular Weight: | 427.48 |
| Molecular Formula: | C19 H21 N7 O3 S |
| Smiles: | C1CN(CCN1CCO)c1ccc(c(c1)Sc1nnnn1c1ccccc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.3958 |
| logD: | 2.2349 |
| logSw: | -2.4959 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.868 |
| InChI Key: | FHBRSZQAIKPQBO-UHFFFAOYSA-N |