[2-(4-benzyl-3,5-dimethyl-1H-pyrazol-1-yl)-4-methyl-1,3-thiazol-5-yl][4-(2-hydroxyethyl)piperazin-1-yl]methanone--hydrogen chloride (1/1)
Chemical Structure Depiction of
[2-(4-benzyl-3,5-dimethyl-1H-pyrazol-1-yl)-4-methyl-1,3-thiazol-5-yl][4-(2-hydroxyethyl)piperazin-1-yl]methanone--hydrogen chloride (1/1)
[2-(4-benzyl-3,5-dimethyl-1H-pyrazol-1-yl)-4-methyl-1,3-thiazol-5-yl][4-(2-hydroxyethyl)piperazin-1-yl]methanone--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D314-0218 |
| Compound Name: | [2-(4-benzyl-3,5-dimethyl-1H-pyrazol-1-yl)-4-methyl-1,3-thiazol-5-yl][4-(2-hydroxyethyl)piperazin-1-yl]methanone--hydrogen chloride (1/1) |
| Molecular Weight: | 476.04 |
| Molecular Formula: | C23 H29 N5 O2 S |
| Salt: | HCl |
| Smiles: | Cc1c(C(N2CCN(CC2)CCO)=O)sc(n1)n1c(C)c(Cc2ccccc2)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.7169 |
| logD: | 2.6638 |
| logSw: | -2.7741 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.876 |
| InChI Key: | FGJKGQAWBQEBAA-UHFFFAOYSA-N |