N-{[2-(4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]carbamothioyl}-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
N-{[2-(4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]carbamothioyl}-1-benzofuran-2-carboxamide
N-{[2-(4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]carbamothioyl}-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | 4059-2010 |
| Compound Name: | N-{[2-(4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]carbamothioyl}-1-benzofuran-2-carboxamide |
| Molecular Weight: | 457.51 |
| Molecular Formula: | C24 H19 N5 O3 S |
| Smiles: | Cc1cc2c(cc1NC(NC(c1cc3ccccc3o1)=O)=S)nn(c1ccc(cc1)OC)n2 |
| Stereo: | ACHIRAL |
| logP: | 5.5403 |
| logD: | 5.5389 |
| logSw: | -6.1923 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.413 |
| InChI Key: | IWSKDUCGDQWJRR-UHFFFAOYSA-N |