methyl 4-({1-(4-chlorophenyl)-2-[4-(4-methyl-1,2,3-thiadiazole-5-carbonyl)piperazin-1-yl]ethoxy}methyl)benzoate
Chemical Structure Depiction of
methyl 4-({1-(4-chlorophenyl)-2-[4-(4-methyl-1,2,3-thiadiazole-5-carbonyl)piperazin-1-yl]ethoxy}methyl)benzoate
methyl 4-({1-(4-chlorophenyl)-2-[4-(4-methyl-1,2,3-thiadiazole-5-carbonyl)piperazin-1-yl]ethoxy}methyl)benzoate
Compound characteristics
| Compound ID: | V002-1848 |
| Compound Name: | methyl 4-({1-(4-chlorophenyl)-2-[4-(4-methyl-1,2,3-thiadiazole-5-carbonyl)piperazin-1-yl]ethoxy}methyl)benzoate |
| Molecular Weight: | 515.03 |
| Molecular Formula: | C25 H27 Cl N4 O4 S |
| Salt: | not_available |
| Smiles: | Cc1c(C(N2CCN(CC2)CC(c2ccc(cc2)[Cl])OCc2ccc(cc2)C(=O)OC)=O)snn1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7102 |
| logD: | 3.7076 |
| logSw: | -4.5752 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.925 |
| InChI Key: | IRMBZSXSARGEME-QFIPXVFZSA-N |