butan-2-yl 2-[(1-ethyl-1H-pyrazole-4-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
butan-2-yl 2-[(1-ethyl-1H-pyrazole-4-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
butan-2-yl 2-[(1-ethyl-1H-pyrazole-4-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y502-9154 |
| Compound Name: | butan-2-yl 2-[(1-ethyl-1H-pyrazole-4-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 375.49 |
| Molecular Formula: | C19 H25 N3 O3 S |
| Smiles: | CCC(C)OC(c1c2CCCCc2sc1NC(c1cnn(CC)c1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0903 |
| logD: | 0.8206 |
| logSw: | -4.1018 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.862 |
| InChI Key: | QTYWZVHNUXDIOR-LBPRGKRZSA-N |