N-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}-N'-(prop-2-en-1-yl)thiourea
Chemical Structure Depiction of
N-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}-N'-(prop-2-en-1-yl)thiourea
N-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}-N'-(prop-2-en-1-yl)thiourea
Compound characteristics
| Compound ID: | D048-0004 |
| Compound Name: | N-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}-N'-(prop-2-en-1-yl)thiourea |
| Molecular Weight: | 320.44 |
| Molecular Formula: | C13 H16 N6 S2 |
| Smiles: | C=CCNC(NCCSc1nnnn1c1ccccc1)=S |
| Stereo: | ACHIRAL |
| logP: | 1.5685 |
| logD: | 1.5685 |
| logSw: | -1.6758 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.582 |
| InChI Key: | CUZRPTTXYFVUIT-UHFFFAOYSA-N |