N-{[4-(1,3-benzothiazol-2-yl)-3-hydroxyphenyl]carbamothioyl}-3,5-dimethoxybenzamide
Chemical Structure Depiction of
N-{[4-(1,3-benzothiazol-2-yl)-3-hydroxyphenyl]carbamothioyl}-3,5-dimethoxybenzamide
N-{[4-(1,3-benzothiazol-2-yl)-3-hydroxyphenyl]carbamothioyl}-3,5-dimethoxybenzamide
Compound characteristics
| Compound ID: | 3339-4611 |
| Compound Name: | N-{[4-(1,3-benzothiazol-2-yl)-3-hydroxyphenyl]carbamothioyl}-3,5-dimethoxybenzamide |
| Molecular Weight: | 465.55 |
| Molecular Formula: | C23 H19 N3 O4 S2 |
| Smiles: | COc1cc(cc(c1)OC)C(NC(Nc1ccc(c(c1)O)c1nc2ccccc2s1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8006 |
| logD: | 5.8004 |
| logSw: | -5.3104 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 74.324 |
| InChI Key: | ANJXMVUHTDNIMR-UHFFFAOYSA-N |