(2-{4-[(4-methoxyphenyl)methyl]-3,5-dimethyl-1H-pyrazol-1-yl}-4-methyl-1,3-thiazol-5-yl)(4-methylpiperazin-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)(4-methylpiperazin-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)(4-methylpiperazin-1-yl)methanone--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D314-0404 |
| Compound Name: | (2-{4-[(4-methoxyphenyl)methyl]-3,5-dimethyl-1H-pyrazol-1-yl}-4-methyl-1,3-thiazol-5-yl)(4-methylpiperazin-1-yl)methanone--hydrogen chloride (1/1) |
| Molecular Weight: | 476.04 |
| Molecular Formula: | C23 H29 N5 O2 S |
| Salt: | HCl |
| Smiles: | Cc1c(C(N2CCN(C)CC2)=O)sc(n1)n1c(C)c(Cc2ccc(cc2)OC)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.1575 |
| logD: | 3.0318 |
| logSw: | -3.2108 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.451 |
| InChI Key: | KUBXEQPQQJPCPZ-UHFFFAOYSA-N |