(2-{4-[(4-chlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-1-yl}-4-methyl-1,3-thiazol-5-yl)(pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
(2-{4-[(4-chlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-1-yl}-4-methyl-1,3-thiazol-5-yl)(pyrrolidin-1-yl)methanone
(2-{4-[(4-chlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-1-yl}-4-methyl-1,3-thiazol-5-yl)(pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | D314-0276 |
| Compound Name: | (2-{4-[(4-chlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-1-yl}-4-methyl-1,3-thiazol-5-yl)(pyrrolidin-1-yl)methanone |
| Molecular Weight: | 451.42 |
| Molecular Formula: | C21 H23 Cl N4 O S |
| Salt: | HCl |
| Smiles: | Cc1c(C(N2CCCC2)=O)sc(n1)n1c(C)c(Cc2ccc(cc2)[Cl])c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.6645 |
| logD: | 4.6114 |
| logSw: | -4.7899 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.796 |
| InChI Key: | WQAXVBHYCCVOCW-UHFFFAOYSA-N |