methyl 2-[(2,3-dihydro-1,4-benzodioxine-6-carbonyl)amino]-5-ethylthiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-[(2,3-dihydro-1,4-benzodioxine-6-carbonyl)amino]-5-ethylthiophene-3-carboxylate
methyl 2-[(2,3-dihydro-1,4-benzodioxine-6-carbonyl)amino]-5-ethylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y200-3802 |
| Compound Name: | methyl 2-[(2,3-dihydro-1,4-benzodioxine-6-carbonyl)amino]-5-ethylthiophene-3-carboxylate |
| Molecular Weight: | 347.39 |
| Molecular Formula: | C17 H17 N O5 S |
| Smiles: | CCc1cc(C(=O)OC)c(NC(c2ccc3c(c2)OCCO3)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.598 |
| logD: | 0.9215 |
| logSw: | -3.1766 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.121 |
| InChI Key: | OQZLAEXLKWRNIP-UHFFFAOYSA-N |