N-{[2-(4-ethoxyphenyl)-2H-benzotriazol-5-yl]carbamothioyl}-3-methyl-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
N-{[2-(4-ethoxyphenyl)-2H-benzotriazol-5-yl]carbamothioyl}-3-methyl-1-benzofuran-2-carboxamide
N-{[2-(4-ethoxyphenyl)-2H-benzotriazol-5-yl]carbamothioyl}-3-methyl-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | 4059-2253 |
| Compound Name: | N-{[2-(4-ethoxyphenyl)-2H-benzotriazol-5-yl]carbamothioyl}-3-methyl-1-benzofuran-2-carboxamide |
| Molecular Weight: | 471.54 |
| Molecular Formula: | C25 H21 N5 O3 S |
| Smiles: | CCOc1ccc(cc1)n1nc2ccc(cc2n1)NC(NC(c1c(C)c2ccccc2o1)=O)=S |
| Stereo: | ACHIRAL |
| logP: | 6.2484 |
| logD: | 6.247 |
| logSw: | -5.6332 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.923 |
| InChI Key: | OABZSVOFMIOHLW-UHFFFAOYSA-N |