3-({2-chloro-N-[(furan-2-yl)methyl]benzamido}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
Chemical Structure Depiction of
3-({2-chloro-N-[(furan-2-yl)methyl]benzamido}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
3-({2-chloro-N-[(furan-2-yl)methyl]benzamido}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
Compound characteristics
| Compound ID: | V031-2068 |
| Compound Name: | 3-({2-chloro-N-[(furan-2-yl)methyl]benzamido}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate |
| Molecular Weight: | 530.43 |
| Molecular Formula: | C26 H21 Cl2 N O5 S |
| Smiles: | Cc1cccc(c1S(=O)(=O)Oc1cccc(CN(Cc2ccco2)C(c2ccccc2[Cl])=O)c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.5614 |
| logD: | 5.5614 |
| logSw: | -5.7783 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.688 |
| InChI Key: | MRLYGKSMAHFHHQ-UHFFFAOYSA-N |