N-{[2-(4-methoxyphenyl)-2H-benzotriazol-5-yl]carbamothioyl}butanamide
Chemical Structure Depiction of
N-{[2-(4-methoxyphenyl)-2H-benzotriazol-5-yl]carbamothioyl}butanamide
N-{[2-(4-methoxyphenyl)-2H-benzotriazol-5-yl]carbamothioyl}butanamide
Compound characteristics
| Compound ID: | 4269-1284 |
| Compound Name: | N-{[2-(4-methoxyphenyl)-2H-benzotriazol-5-yl]carbamothioyl}butanamide |
| Molecular Weight: | 369.44 |
| Molecular Formula: | C18 H19 N5 O2 S |
| Smiles: | CCCC(NC(Nc1ccc2c(c1)nn(c1ccc(cc1)OC)n2)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6941 |
| logD: | 3.6866 |
| logSw: | -4.047 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.876 |
| InChI Key: | VGKQGTMBCIXOFT-UHFFFAOYSA-N |