4-({(cyclobutanecarbonyl)[(furan-2-yl)methyl]amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
Chemical Structure Depiction of
4-({(cyclobutanecarbonyl)[(furan-2-yl)methyl]amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
4-({(cyclobutanecarbonyl)[(furan-2-yl)methyl]amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
Compound characteristics
| Compound ID: | V003-9817 |
| Compound Name: | 4-({(cyclobutanecarbonyl)[(furan-2-yl)methyl]amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate |
| Molecular Weight: | 473.97 |
| Molecular Formula: | C24 H24 Cl N O5 S |
| Smiles: | Cc1cccc(c1S(=O)(=O)Oc1ccc(CN(Cc2ccco2)C(C2CCC2)=O)cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.4012 |
| logD: | 4.4012 |
| logSw: | -4.4153 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.211 |
| InChI Key: | DIMCADOMGPZQMA-UHFFFAOYSA-N |