N-phenyl-N'-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}thiourea
Chemical Structure Depiction of
N-phenyl-N'-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}thiourea
N-phenyl-N'-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}thiourea
Compound characteristics
| Compound ID: | D048-0003 |
| Compound Name: | N-phenyl-N'-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}thiourea |
| Molecular Weight: | 356.47 |
| Molecular Formula: | C16 H16 N6 S2 |
| Smiles: | C(CSc1nnnn1c1ccccc1)NC(Nc1ccccc1)=S |
| Stereo: | ACHIRAL |
| logP: | 2.7488 |
| logD: | 2.7488 |
| logSw: | -3.0108 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.146 |
| InChI Key: | LBPHFFBOZVYYME-UHFFFAOYSA-N |