methyl 4-({2-[4-(2,5-dichlorothiophene-3-sulfonyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethoxy}methyl)benzoate
Chemical Structure Depiction of
methyl 4-({2-[4-(2,5-dichlorothiophene-3-sulfonyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethoxy}methyl)benzoate
methyl 4-({2-[4-(2,5-dichlorothiophene-3-sulfonyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethoxy}methyl)benzoate
Compound characteristics
| Compound ID: | V005-9920 |
| Compound Name: | methyl 4-({2-[4-(2,5-dichlorothiophene-3-sulfonyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethoxy}methyl)benzoate |
| Molecular Weight: | 599.55 |
| Molecular Formula: | C26 H28 Cl2 N2 O6 S2 |
| Salt: | not_available |
| Smiles: | COC(c1ccc(COC(CN2CCN(CC2)S(c2cc(sc2[Cl])[Cl])(=O)=O)c2cccc(c2)OC)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0669 |
| logD: | 5.0662 |
| logSw: | -5.3796 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 72.106 |
| InChI Key: | SQYYISQKZKXEGK-QFIPXVFZSA-N |