methyl 2-{[4-(1,3-benzothiazol-2-yl)phenyl]carbamamido}benzoate
Chemical Structure Depiction of
methyl 2-{[4-(1,3-benzothiazol-2-yl)phenyl]carbamamido}benzoate
methyl 2-{[4-(1,3-benzothiazol-2-yl)phenyl]carbamamido}benzoate
Compound characteristics
| Compound ID: | L320-0011 |
| Compound Name: | methyl 2-{[4-(1,3-benzothiazol-2-yl)phenyl]carbamamido}benzoate |
| Molecular Weight: | 403.46 |
| Molecular Formula: | C22 H17 N3 O3 S |
| Smiles: | COC(c1ccccc1NC(Nc1ccc(cc1)c1nc2ccccc2s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4211 |
| logD: | 5.4191 |
| logSw: | -5.4673 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.466 |
| InChI Key: | JIWKCYYPAKMDCO-UHFFFAOYSA-N |