ethyl 2-[(3,4-dihydro-2H-1-benzopyran-3-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[(3,4-dihydro-2H-1-benzopyran-3-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-[(3,4-dihydro-2H-1-benzopyran-3-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 8582-1340 |
| Compound Name: | ethyl 2-[(3,4-dihydro-2H-1-benzopyran-3-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 385.48 |
| Molecular Formula: | C21 H23 N O4 S |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(C1Cc2ccccc2OC1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4443 |
| logD: | 1.0581 |
| logSw: | -4.3732 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.168 |
| InChI Key: | MRCWSAZUKJSVPY-AWEZNQCLSA-N |