ethyl 2-[(2-ethyl-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[(2-ethyl-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-[(2-ethyl-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | E216-5358 |
| Compound Name: | ethyl 2-[(2-ethyl-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 414.52 |
| Molecular Formula: | C22 H26 N2 O4 S |
| Smiles: | CCC1CN(C(Nc2c(C(=O)OCC)c3CCCCc3s2)=O)c2ccccc2O1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.206 |
| logD: | 4.6615 |
| logSw: | -5.1014 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.084 |
| InChI Key: | LNSAMTOKPKKTSS-CQSZACIVSA-N |