N-(3-chlorophenyl)-N'-[1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-1H-1,2,4-triazol-3-yl]urea
Chemical Structure Depiction of
N-(3-chlorophenyl)-N'-[1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-1H-1,2,4-triazol-3-yl]urea
N-(3-chlorophenyl)-N'-[1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-1H-1,2,4-triazol-3-yl]urea
Compound characteristics
| Compound ID: | 8012-0068 |
| Compound Name: | N-(3-chlorophenyl)-N'-[1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-1H-1,2,4-triazol-3-yl]urea |
| Molecular Weight: | 376.76 |
| Molecular Formula: | C14 H13 Cl N8 O3 |
| Smiles: | COc1nc(nc(n1)OC)n1cnc(NC(Nc2cccc(c2)[Cl])=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.6277 |
| logD: | 3.6271 |
| logSw: | -3.8613 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.098 |
| InChI Key: | RJGNAPCFOSNRMM-UHFFFAOYSA-N |