N-(2H-1,3-benzodioxol-5-yl)-6-chloro-3-methoxy-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-6-chloro-3-methoxy-1-benzothiophene-2-carboxamide
N-(2H-1,3-benzodioxol-5-yl)-6-chloro-3-methoxy-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | M648-1445 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-6-chloro-3-methoxy-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 361.8 |
| Molecular Formula: | C17 H12 Cl N O4 S |
| Smiles: | COc1c2ccc(cc2sc1C(Nc1ccc2c(c1)OCO2)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.5296 |
| logD: | 4.5245 |
| logSw: | -4.6402 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.909 |
| InChI Key: | CTYWVOGUGOVEOB-UHFFFAOYSA-N |