N-(3-chloro-2-methylphenyl)-N'-(4H-1,2,4-triazol-4-yl)thiourea
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-N'-(4H-1,2,4-triazol-4-yl)thiourea
N-(3-chloro-2-methylphenyl)-N'-(4H-1,2,4-triazol-4-yl)thiourea
Compound characteristics
| Compound ID: | 8015-2547 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-N'-(4H-1,2,4-triazol-4-yl)thiourea |
| Molecular Weight: | 267.74 |
| Molecular Formula: | C10 H10 Cl N5 S |
| Smiles: | Cc1c(cccc1[Cl])NC(Nn1cnnc1)=S |
| Stereo: | ACHIRAL |
| logP: | 2.0862 |
| logD: | 2.0816 |
| logSw: | -2.6187 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 45.225 |
| InChI Key: | GBNHAENILDIMGQ-UHFFFAOYSA-N |