methyl 4-({2-[4-(2,1,3-benzoxadiazole-5-carbonyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethoxy}methyl)benzoate
Chemical Structure Depiction of
methyl 4-({2-[4-(2,1,3-benzoxadiazole-5-carbonyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethoxy}methyl)benzoate
methyl 4-({2-[4-(2,1,3-benzoxadiazole-5-carbonyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethoxy}methyl)benzoate
Compound characteristics
| Compound ID: | V008-5285 |
| Compound Name: | methyl 4-({2-[4-(2,1,3-benzoxadiazole-5-carbonyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethoxy}methyl)benzoate |
| Molecular Weight: | 530.58 |
| Molecular Formula: | C29 H30 N4 O6 |
| Salt: | not_available |
| Smiles: | COC(c1ccc(COC(CN2CCN(CC2)C(c2ccc3c(c2)non3)=O)c2cccc(c2)OC)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9845 |
| logD: | 3.983 |
| logSw: | -4.1819 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 91.345 |
| InChI Key: | QQWJMCNFQMGTEU-MHZLTWQESA-N |