4-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamoyl]phenyl 1-methyl-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
4-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamoyl]phenyl 1-methyl-1H-pyrazole-3-carboxylate
4-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamoyl]phenyl 1-methyl-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | 8016-8143 |
| Compound Name: | 4-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamoyl]phenyl 1-methyl-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 392.43 |
| Molecular Formula: | C20 H16 N4 O3 S |
| Smiles: | Cn1ccc(C(=O)Oc2ccc(cc2)C(Nc2c(C#N)c3CCCc3s2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.6222 |
| logD: | 0.2987 |
| logSw: | -3.1782 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.537 |
| InChI Key: | FSJFRVRGFYEHKX-UHFFFAOYSA-N |