4-({N-[(furan-2-yl)methyl](2-methoxyphenyl)carbamamido}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
Chemical Structure Depiction of
4-({N-[(furan-2-yl)methyl](2-methoxyphenyl)carbamamido}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
4-({N-[(furan-2-yl)methyl](2-methoxyphenyl)carbamamido}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
Compound characteristics
| Compound ID: | V030-3736 |
| Compound Name: | 4-({N-[(furan-2-yl)methyl](2-methoxyphenyl)carbamamido}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate |
| Molecular Weight: | 541.02 |
| Molecular Formula: | C27 H25 Cl N2 O6 S |
| Smiles: | Cc1cccc(c1S(=O)(=O)Oc1ccc(CN(Cc2ccco2)C(Nc2ccccc2OC)=O)cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.6526 |
| logD: | 5.6526 |
| logSw: | -5.848 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.442 |
| InChI Key: | DRUGUSBXEMXRLE-UHFFFAOYSA-N |