4-{[(cyclobutanecarbonyl)(2-methoxyethyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate
Chemical Structure Depiction of
4-{[(cyclobutanecarbonyl)(2-methoxyethyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate
4-{[(cyclobutanecarbonyl)(2-methoxyethyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate
Compound characteristics
| Compound ID: | V029-6733 |
| Compound Name: | 4-{[(cyclobutanecarbonyl)(2-methoxyethyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate |
| Molecular Weight: | 451.97 |
| Molecular Formula: | C22 H26 Cl N O5 S |
| Smiles: | Cc1cccc(c1S(=O)(=O)Oc1ccc(CN(CCOC)C(C2CCC2)=O)cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.4435 |
| logD: | 3.4435 |
| logSw: | -3.6047 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.055 |
| InChI Key: | SMSDJRYVTBDIHS-UHFFFAOYSA-N |