N-{[2-(4-methoxyphenyl)-2H-benzotriazol-5-yl]carbamothioyl}-3-methyl-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
N-{[2-(4-methoxyphenyl)-2H-benzotriazol-5-yl]carbamothioyl}-3-methyl-1-benzofuran-2-carboxamide
N-{[2-(4-methoxyphenyl)-2H-benzotriazol-5-yl]carbamothioyl}-3-methyl-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | 4059-2252 |
| Compound Name: | N-{[2-(4-methoxyphenyl)-2H-benzotriazol-5-yl]carbamothioyl}-3-methyl-1-benzofuran-2-carboxamide |
| Molecular Weight: | 457.51 |
| Molecular Formula: | C24 H19 N5 O3 S |
| Smiles: | Cc1c2ccccc2oc1C(NC(Nc1ccc2c(c1)nn(c1ccc(cc1)OC)n2)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8619 |
| logD: | 5.8604 |
| logSw: | -5.7706 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.344 |
| InChI Key: | NQEKNHADDGOOHW-UHFFFAOYSA-N |