methyl 4-({2-[4-(5-chloro-1,3-dimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethoxy}methyl)benzoate
Chemical Structure Depiction of
methyl 4-({2-[4-(5-chloro-1,3-dimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethoxy}methyl)benzoate
methyl 4-({2-[4-(5-chloro-1,3-dimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethoxy}methyl)benzoate
Compound characteristics
| Compound ID: | V009-6826 |
| Compound Name: | methyl 4-({2-[4-(5-chloro-1,3-dimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethoxy}methyl)benzoate |
| Molecular Weight: | 577.1 |
| Molecular Formula: | C27 H33 Cl N4 O6 S |
| Salt: | not_available |
| Smiles: | Cc1c(c(n(C)n1)[Cl])S(N1CCN(CC1)CC(c1cccc(c1)OC)OCc1ccc(cc1)C(=O)OC)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7385 |
| logD: | 2.7378 |
| logSw: | -3.5515 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 86.309 |
| InChI Key: | MVKXLEHICDDVNL-DEOSSOPVSA-N |