4-({acetyl[(furan-2-yl)methyl]amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
Chemical Structure Depiction of
4-({acetyl[(furan-2-yl)methyl]amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
4-({acetyl[(furan-2-yl)methyl]amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
Compound characteristics
| Compound ID: | V030-8680 |
| Compound Name: | 4-({acetyl[(furan-2-yl)methyl]amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate |
| Molecular Weight: | 433.91 |
| Molecular Formula: | C21 H20 Cl N O5 S |
| Smiles: | CC(N(Cc1ccc(cc1)OS(c1c(C)cccc1[Cl])(=O)=O)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8184 |
| logD: | 3.8184 |
| logSw: | -4.0498 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.428 |
| InChI Key: | VXLSVKCHZUYASW-UHFFFAOYSA-N |