3-({(cyclobutanecarbonyl)[(furan-2-yl)methyl]amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
Chemical Structure Depiction of
3-({(cyclobutanecarbonyl)[(furan-2-yl)methyl]amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
3-({(cyclobutanecarbonyl)[(furan-2-yl)methyl]amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
Compound characteristics
| Compound ID: | V031-2044 |
| Compound Name: | 3-({(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)Oc1cccc(CN(Cc2ccco2)C(C2CCC2)=O)c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.4432 |
| logD: | 4.4432 |
| logSw: | -4.5186 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.211 |
| InChI Key: | NSBZKFFMVOJDEC-UHFFFAOYSA-N |