N-[7-(4-methylbenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]thiophene-2-carboxamide
Chemical Structure Depiction of
N-[7-(4-methylbenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]thiophene-2-carboxamide
N-[7-(4-methylbenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]thiophene-2-carboxamide
Compound characteristics
| Compound ID: | 8019-0179 |
| Compound Name: | N-[7-(4-methylbenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]thiophene-2-carboxamide |
| Molecular Weight: | 379.43 |
| Molecular Formula: | C21 H17 N O4 S |
| Smiles: | Cc1ccc(cc1)C(c1cc2c(cc1NC(c1cccs1)=O)OCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4397 |
| logD: | 3.4328 |
| logSw: | -3.7008 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.94 |
| InChI Key: | HJLHXFGCJMKUMY-UHFFFAOYSA-N |