N-[7-(4-methoxybenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]thiophene-2-carboxamide
Chemical Structure Depiction of
N-[7-(4-methoxybenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]thiophene-2-carboxamide
N-[7-(4-methoxybenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]thiophene-2-carboxamide
Compound characteristics
Compound ID: | 8019-7030 |
Compound Name: | N-[7-(4-methoxybenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]thiophene-2-carboxamide |
Molecular Weight: | 395.43 |
Molecular Formula: | C21 H17 N O5 S |
Smiles: | COc1ccc(cc1)C(c1cc2c(cc1NC(c1cccs1)=O)OCCO2)=O |
Stereo: | ACHIRAL |
logP: | 2.9987 |
logD: | 2.9918 |
logSw: | -3.6193 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 60.484 |
InChI Key: | QITUPEDRZBTRCW-UHFFFAOYSA-N |