N-[(2-chloro-4-fluorophenyl)methyl]-3-(3,4-dimethoxyphenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carboxamide
Chemical Structure Depiction of
N-[(2-chloro-4-fluorophenyl)methyl]-3-(3,4-dimethoxyphenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carboxamide
N-[(2-chloro-4-fluorophenyl)methyl]-3-(3,4-dimethoxyphenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | C453-0454 |
| Compound Name: | N-[(2-chloro-4-fluorophenyl)methyl]-3-(3,4-dimethoxyphenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carboxamide |
| Molecular Weight: | 459.93 |
| Molecular Formula: | C22 H19 Cl F N3 O3 S |
| Smiles: | Cn1c2c(cc(C(NCc3ccc(cc3[Cl])F)=O)s2)c(c2ccc(c(c2)OC)OC)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.5703 |
| logD: | 4.5703 |
| logSw: | -4.6986 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.03 |
| InChI Key: | COFLFBKSLSHIMA-UHFFFAOYSA-N |