propan-2-yl 2-[(1-methyl-1H-pyrazole-5-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
propan-2-yl 2-[(1-methyl-1H-pyrazole-5-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
propan-2-yl 2-[(1-methyl-1H-pyrazole-5-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y500-7941 |
| Compound Name: | propan-2-yl 2-[(1-methyl-1H-pyrazole-5-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 347.43 |
| Molecular Formula: | C17 H21 N3 O3 S |
| Smiles: | CC(C)OC(c1c2CCCCc2sc1NC(c1ccnn1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0218 |
| logD: | -0.6821 |
| logSw: | -3.4923 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.127 |
| InChI Key: | HQUGZWMMUOXZDC-UHFFFAOYSA-N |