3-({N-[(furan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenyl 4-acetamidobenzene-1-sulfonate
Chemical Structure Depiction of
3-({N-[(furan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenyl 4-acetamidobenzene-1-sulfonate
3-({N-[(furan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenyl 4-acetamidobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-7833 |
| Compound Name: | 3-({N-[(furan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenyl 4-acetamidobenzene-1-sulfonate |
| Molecular Weight: | 485.56 |
| Molecular Formula: | C24 H27 N3 O6 S |
| Smiles: | CC(C)NC(N(Cc1cccc(c1)OS(c1ccc(cc1)NC(C)=O)(=O)=O)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.389 |
| logD: | 3.3888 |
| logSw: | -3.9448 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.339 |
| InChI Key: | KNBWOPLTPXPRCY-UHFFFAOYSA-N |