(2-{4-[(4-methoxyphenyl)methyl]-3,5-dimethyl-1H-pyrazol-1-yl}-4-methyl-1,3-thiazol-5-yl)(pyrrolidin-1-yl)methanone--hydrogen chloride (1/1)
Chemical Structure Depiction of
(2-{4-[(4-methoxyphenyl)methyl]-3,5-dimethyl-1H-pyrazol-1-yl}-4-methyl-1,3-thiazol-5-yl)(pyrrolidin-1-yl)methanone--hydrogen chloride (1/1)
(2-{4-[(4-methoxyphenyl)methyl]-3,5-dimethyl-1H-pyrazol-1-yl}-4-methyl-1,3-thiazol-5-yl)(pyrrolidin-1-yl)methanone--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D314-0406 |
| Compound Name: | (2-{4-[(4-methoxyphenyl)methyl]-3,5-dimethyl-1H-pyrazol-1-yl}-4-methyl-1,3-thiazol-5-yl)(pyrrolidin-1-yl)methanone--hydrogen chloride (1/1) |
| Molecular Weight: | 447 |
| Molecular Formula: | C22 H26 N4 O2 S |
| Salt: | HCl |
| Smiles: | Cc1c(C(N2CCCC2)=O)sc(n1)n1c(C)c(Cc2ccc(cc2)OC)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.0522 |
| logD: | 3.9991 |
| logSw: | -4.1799 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.34 |
| InChI Key: | NFNWBLVSDJPKMY-UHFFFAOYSA-N |