3-({(cyclobutanecarbonyl)[(4-fluorophenyl)methyl]amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
Chemical Structure Depiction of
3-({(cyclobutanecarbonyl)[(4-fluorophenyl)methyl]amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
3-({(cyclobutanecarbonyl)[(4-fluorophenyl)methyl]amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
Compound characteristics
| Compound ID: | V028-1573 |
| Compound Name: | 3-({(cyclobutanecarbonyl)[(4-fluorophenyl)methyl]amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate |
| Molecular Weight: | 502 |
| Molecular Formula: | C26 H25 Cl F N O4 S |
| Smiles: | Cc1cccc(c1S(=O)(=O)Oc1cccc(CN(Cc2ccc(cc2)F)C(C2CCC2)=O)c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.9418 |
| logD: | 4.9418 |
| logSw: | -4.967 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.463 |
| InChI Key: | LIENSIVIWQOZNJ-UHFFFAOYSA-N |