methyl 4-{[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamoyl}benzoate
Chemical Structure Depiction of
methyl 4-{[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamoyl}benzoate
methyl 4-{[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamoyl}benzoate
Compound characteristics
| Compound ID: | G841-0046 |
| Compound Name: | methyl 4-{[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamoyl}benzoate |
| Molecular Weight: | 402.47 |
| Molecular Formula: | C23 H18 N2 O3 S |
| Smiles: | Cc1ccc2c(c1)sc(c1ccc(cc1)NC(c1ccc(cc1)C(=O)OC)=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 5.5245 |
| logD: | 5.5244 |
| logSw: | -5.4013 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.952 |
| InChI Key: | CFUHXBOHHHNUOO-UHFFFAOYSA-N |