N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-chloro-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-chloro-1-benzothiophene-2-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-chloro-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | 8005-8299 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-chloro-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 345.8 |
| Molecular Formula: | C17 H12 Cl N O3 S |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(c1c(c2ccccc2s1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.3819 |
| logD: | 4.3819 |
| logSw: | -4.6534 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.514 |
| InChI Key: | UQUCTANHHAXWHB-UHFFFAOYSA-N |