ethyl 2-[(1-benzoxepine-4-carbonyl)amino]-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[(1-benzoxepine-4-carbonyl)amino]-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-[(1-benzoxepine-4-carbonyl)amino]-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | D443-0128 |
| Compound Name: | ethyl 2-[(1-benzoxepine-4-carbonyl)amino]-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 423.53 |
| Molecular Formula: | C24 H25 N O4 S |
| Smiles: | CCC1CCc2c(C(=O)OCC)c(NC(C3C=COc4ccccc4C=3)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.179 |
| logD: | 3.689 |
| logSw: | -5.7183 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.423 |
| InChI Key: | GDFYYJIELBGORL-OAHLLOKOSA-N |