N-(2H-1,3-benzodioxol-5-yl)-5-chloro-3-methoxy-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-5-chloro-3-methoxy-1-benzothiophene-2-carboxamide
N-(2H-1,3-benzodioxol-5-yl)-5-chloro-3-methoxy-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | M648-1223 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-5-chloro-3-methoxy-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 361.8 |
| Molecular Formula: | C17 H12 Cl N O4 S |
| Smiles: | COc1c2cc(ccc2sc1C(Nc1ccc2c(c1)OCO2)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.4232 |
| logD: | 4.4181 |
| logSw: | -4.5156 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.909 |
| InChI Key: | HXXPQZJLPPFTKR-UHFFFAOYSA-N |