ethyl 2-[3-(1,5-dimethyl-1H-pyrazol-4-yl)prop-2-enamido]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[3-(1,5-dimethyl-1H-pyrazol-4-yl)prop-2-enamido]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
ethyl 2-[3-(1,5-dimethyl-1H-pyrazol-4-yl)prop-2-enamido]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y500-8065 |
| Compound Name: | ethyl 2-[3-(1,5-dimethyl-1H-pyrazol-4-yl)prop-2-enamido]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate |
| Molecular Weight: | 359.45 |
| Molecular Formula: | C18 H21 N3 O3 S |
| Smiles: | CCOC(c1c2CCCc2sc1NC(/C=C/c1cnn(C)c1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8491 |
| logD: | 1.2527 |
| logSw: | -3.2258 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.437 |
| InChI Key: | AIYMOWBQLBPKGD-UHFFFAOYSA-N |