4-chloro-2-({(cyclobutanecarbonyl)[(oxolan-2-yl)methyl]amino}methyl)phenyl 4-acetamidobenzene-1-sulfonate
Chemical Structure Depiction of
4-chloro-2-({(cyclobutanecarbonyl)[(oxolan-2-yl)methyl]amino}methyl)phenyl 4-acetamidobenzene-1-sulfonate
4-chloro-2-({(cyclobutanecarbonyl)[(oxolan-2-yl)methyl]amino}methyl)phenyl 4-acetamidobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V015-9237 |
| Compound Name: | 4-chloro-2-({(cyclobutanecarbonyl)[(oxolan-2-yl)methyl]amino}methyl)phenyl 4-acetamidobenzene-1-sulfonate |
| Molecular Weight: | 521.03 |
| Molecular Formula: | C25 H29 Cl N2 O6 S |
| Smiles: | CC(Nc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1CN(CC1CCCO1)C(C1CCC1)=O)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0182 |
| logD: | 3.0181 |
| logSw: | -3.6407 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.465 |
| InChI Key: | RJTSOGKXIJWEEW-JOCHJYFZSA-N |