5-{[(cyclobutanecarbonyl)(propan-2-yl)amino]methyl}-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate
Chemical Structure Depiction of
5-{[(cyclobutanecarbonyl)(propan-2-yl)amino]methyl}-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate
5-{[(cyclobutanecarbonyl)(propan-2-yl)amino]methyl}-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V029-8400 |
| Compound Name: | 5-{[(cyclobutanecarbonyl)(propan-2-yl)amino]methyl}-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate |
| Molecular Weight: | 486.41 |
| Molecular Formula: | C22 H25 Cl2 N O5 S |
| Smiles: | CC(C)N(Cc1ccc(c(c1)OS(c1ccc(c(c1)[Cl])[Cl])(=O)=O)OC)C(C1CCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5332 |
| logD: | 4.5332 |
| logSw: | -4.6005 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.195 |
| InChI Key: | JIGLEQNPVKNOTD-UHFFFAOYSA-N |