N-(3-acetylphenyl)-N'-{1-[(3,4-dichlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}urea
Chemical Structure Depiction of
N-(3-acetylphenyl)-N'-{1-[(3,4-dichlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}urea
N-(3-acetylphenyl)-N'-{1-[(3,4-dichlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}urea
Compound characteristics
| Compound ID: | Y205-1917 |
| Compound Name: | N-(3-acetylphenyl)-N'-{1-[(3,4-dichlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}urea |
| Molecular Weight: | 404.25 |
| Molecular Formula: | C18 H15 Cl2 N5 O2 |
| Smiles: | CC(c1cccc(c1)NC(Nc1ncn(Cc2ccc(c(c2)[Cl])[Cl])n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3939 |
| logD: | 4.3932 |
| logSw: | -4.5346 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.59 |
| InChI Key: | GMZODRIOZVBUFW-UHFFFAOYSA-N |