5-({(cyclobutanecarbonyl)[(oxolan-2-yl)methyl]amino}methyl)-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate
Chemical Structure Depiction of
5-({(cyclobutanecarbonyl)[(oxolan-2-yl)methyl]amino}methyl)-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate
5-({(cyclobutanecarbonyl)[(oxolan-2-yl)methyl]amino}methyl)-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V025-5612 |
| Compound Name: | 5-({(cyclobutanecarbonyl)[(oxolan-2-yl)methyl]amino}methyl)-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate |
| Molecular Weight: | 528.45 |
| Molecular Formula: | C24 H27 Cl2 N O6 S |
| Smiles: | COc1ccc(CN(CC2CCCO2)C(C2CCC2)=O)cc1OS(c1ccc(c(c1)[Cl])[Cl])(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8499 |
| logD: | 3.8499 |
| logSw: | -4.2313 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.834 |
| InChI Key: | FBKTXZGVXYVCAV-GOSISDBHSA-N |