dimethyl 5-{[1-(1,5-dimethyl-1H-pyrazole-4-sulfonyl)piperidine-3-carbonyl]amino}-3-methylthiophene-2,4-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-{[1-(1,5-dimethyl-1H-pyrazole-4-sulfonyl)piperidine-3-carbonyl]amino}-3-methylthiophene-2,4-dicarboxylate
dimethyl 5-{[1-(1,5-dimethyl-1H-pyrazole-4-sulfonyl)piperidine-3-carbonyl]amino}-3-methylthiophene-2,4-dicarboxylate
Compound characteristics
| Compound ID: | Y503-3461 |
| Compound Name: | dimethyl 5-{[1-(1,5-dimethyl-1H-pyrazole-4-sulfonyl)piperidine-3-carbonyl]amino}-3-methylthiophene-2,4-dicarboxylate |
| Molecular Weight: | 498.58 |
| Molecular Formula: | C20 H26 N4 O7 S2 |
| Smiles: | Cc1c(C(=O)OC)c(NC(C2CCCN(C2)S(c2cnn(C)c2C)(=O)=O)=O)sc1C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.8203 |
| logD: | -2.3917 |
| logSw: | -2.1137 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 111.603 |
| InChI Key: | DPSKKJNTPINKND-ZDUSSCGKSA-N |