methyl 4-[(4-chloro-1,3-benzothiazol-7-yl)carbamoyl]benzoate
Chemical Structure Depiction of
methyl 4-[(4-chloro-1,3-benzothiazol-7-yl)carbamoyl]benzoate
methyl 4-[(4-chloro-1,3-benzothiazol-7-yl)carbamoyl]benzoate
Compound characteristics
| Compound ID: | F488-0041 |
| Compound Name: | methyl 4-[(4-chloro-1,3-benzothiazol-7-yl)carbamoyl]benzoate |
| Molecular Weight: | 346.79 |
| Molecular Formula: | C16 H11 Cl N2 O3 S |
| Smiles: | COC(c1ccc(cc1)C(Nc1ccc(c2c1scn2)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7469 |
| logD: | 3.4735 |
| logSw: | -4.279 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.919 |
| InChI Key: | ZLKCJJMQFYVMCE-UHFFFAOYSA-N |