3-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-1,1-dioxo-N-phenyl-1H-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
3-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-1,1-dioxo-N-phenyl-1H-1-benzothiophene-2-carboxamide
3-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-1,1-dioxo-N-phenyl-1H-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | J087-0165 |
| Compound Name: | 3-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-1,1-dioxo-N-phenyl-1H-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 434.47 |
| Molecular Formula: | C23 H18 N2 O5 S |
| Smiles: | C(c1ccc2c(c1)OCO2)NC1=C(C(Nc2ccccc2)=O)S(c2ccccc12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.894 |
| logD: | 2.8934 |
| logSw: | -3.7147 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.146 |
| InChI Key: | LTHRZNUQRKLOFI-UHFFFAOYSA-N |