ethyl N-{3-[4-(5-chloro-2-methylphenyl)piperazine-1-sulfonyl]-1-methyl-1H-pyrazole-4-carbonyl}glycinate
Chemical Structure Depiction of
ethyl N-{3-[4-(5-chloro-2-methylphenyl)piperazine-1-sulfonyl]-1-methyl-1H-pyrazole-4-carbonyl}glycinate
ethyl N-{3-[4-(5-chloro-2-methylphenyl)piperazine-1-sulfonyl]-1-methyl-1H-pyrazole-4-carbonyl}glycinate
Compound characteristics
| Compound ID: | M461-6527 |
| Compound Name: | ethyl N-{3-[4-(5-chloro-2-methylphenyl)piperazine-1-sulfonyl]-1-methyl-1H-pyrazole-4-carbonyl}glycinate |
| Molecular Weight: | 483.97 |
| Molecular Formula: | C20 H26 Cl N5 O5 S |
| Smiles: | CCOC(CNC(c1cn(C)nc1S(N1CCN(CC1)c1cc(ccc1C)[Cl])(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4298 |
| logD: | 2.4298 |
| logSw: | -3.4781 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.883 |
| InChI Key: | QIRLQKCRAKNHEX-UHFFFAOYSA-N |