methyl 3-{[4-(propan-2-yl)phenyl]sulfamoyl}-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-{[4-(propan-2-yl)phenyl]sulfamoyl}-1-benzothiophene-2-carboxylate
methyl 3-{[4-(propan-2-yl)phenyl]sulfamoyl}-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | G226-0646 |
| Compound Name: | methyl 3-{[4-(propan-2-yl)phenyl]sulfamoyl}-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 389.49 |
| Molecular Formula: | C19 H19 N O4 S2 |
| Smiles: | CC(C)c1ccc(cc1)NS(c1c2ccccc2sc1C(=O)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1218 |
| logD: | 5.0857 |
| logSw: | -5.2476 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.809 |
| InChI Key: | KAGZBXCAWDXEKS-UHFFFAOYSA-N |