N-[2-(4-fluorophenyl)-2,6-dihydro-4H-thieno[3,4-c]pyrazol-3-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-enamide
Chemical Structure Depiction of
N-[2-(4-fluorophenyl)-2,6-dihydro-4H-thieno[3,4-c]pyrazol-3-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-enamide
N-[2-(4-fluorophenyl)-2,6-dihydro-4H-thieno[3,4-c]pyrazol-3-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-enamide
Compound characteristics
| Compound ID: | K409-0322 |
| Compound Name: | N-[2-(4-fluorophenyl)-2,6-dihydro-4H-thieno[3,4-c]pyrazol-3-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-enamide |
| Molecular Weight: | 455.51 |
| Molecular Formula: | C23 H22 F N3 O4 S |
| Smiles: | COc1cc(\C=C/C(Nc2c3CSCc3nn2c2ccc(cc2)F)=O)cc(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 3.9968 |
| logD: | 3.9967 |
| logSw: | -4.2704 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.395 |
| InChI Key: | KSVAXUIERUPYLN-UHFFFAOYSA-N |