ethyl 2-[(2-ethyl-2,3-dihydro-4H-1,4-benzothiazine-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-benzothiazine-4-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-[(2-ethyl-2,3-dihydro-4H-1,4-benzothiazine-4-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | E628-1080 |
| Compound Name: | ethyl 2-[(2-ethyl-2,3-dihydro-4H-1,4-benzothiazine-4-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 430.59 |
| Molecular Formula: | C22 H26 N2 O3 S2 |
| Smiles: | CCC1CN(C(Nc2c(C(=O)OCC)c3CCCCc3s2)=O)c2ccccc2S1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.095 |
| logD: | 5.5447 |
| logSw: | -5.49 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.774 |
| InChI Key: | PGMFDZRBBWWHCA-AWEZNQCLSA-N |