3-({acetyl[(furan-2-yl)methyl]amino}methyl)phenyl 4-acetamidobenzene-1-sulfonate
Chemical Structure Depiction of
3-({acetyl[(furan-2-yl)methyl]amino}methyl)phenyl 4-acetamidobenzene-1-sulfonate
3-({acetyl[(furan-2-yl)methyl]amino}methyl)phenyl 4-acetamidobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-1802 |
| Compound Name: | 3-({acetyl[(furan-2-yl)methyl]amino}methyl)phenyl 4-acetamidobenzene-1-sulfonate |
| Molecular Weight: | 442.49 |
| Molecular Formula: | C22 H22 N2 O6 S |
| Smiles: | CC(Nc1ccc(cc1)S(=O)(=O)Oc1cccc(CN(Cc2ccco2)C(C)=O)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4855 |
| logD: | 2.4854 |
| logSw: | -2.9388 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.69 |
| InChI Key: | UHIMSJLAXDZAHW-UHFFFAOYSA-N |