5-(diethylamino)-2-({N-[(furan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenyl 3,4-dichlorobenzene-1-sulfonate
Chemical Structure Depiction of
5-(diethylamino)-2-({N-[(furan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenyl 3,4-dichlorobenzene-1-sulfonate
5-(diethylamino)-2-({N-[(furan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenyl 3,4-dichlorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V031-2003 |
| Compound Name: | 5-(diethylamino)-2-({N-[(furan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenyl 3,4-dichlorobenzene-1-sulfonate |
| Molecular Weight: | 568.52 |
| Molecular Formula: | C26 H31 Cl2 N3 O5 S |
| Salt: | not_available |
| Smiles: | CCN(CC)c1ccc(CN(Cc2ccco2)C(NC(C)C)=O)c(c1)OS(c1ccc(c(c1)[Cl])[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2745 |
| logD: | 6.2638 |
| logSw: | -6.1814 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.9 |
| InChI Key: | IMFCEHFNLOUSQJ-UHFFFAOYSA-N |