2-{[(butan-2-yl)(furan-2-carbonyl)amino]methyl}-5-(diethylamino)phenyl 3,4-dichlorobenzene-1-sulfonate
Chemical Structure Depiction of
2-{[(butan-2-yl)(furan-2-carbonyl)amino]methyl}-5-(diethylamino)phenyl 3,4-dichlorobenzene-1-sulfonate
2-{[(butan-2-yl)(furan-2-carbonyl)amino]methyl}-5-(diethylamino)phenyl 3,4-dichlorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V029-2725 |
| Compound Name: | 2-{[(butan-2-yl)(furan-2-carbonyl)amino]methyl}-5-(diethylamino)phenyl 3,4-dichlorobenzene-1-sulfonate |
| Molecular Weight: | 553.5 |
| Molecular Formula: | C26 H30 Cl2 N2 O5 S |
| Salt: | not_available |
| Smiles: | CCC(C)N(Cc1ccc(cc1OS(c1ccc(c(c1)[Cl])[Cl])(=O)=O)N(CC)CC)C(c1ccco1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.4609 |
| logD: | 6.4501 |
| logSw: | -6.255 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.94 |
| InChI Key: | AYBJFYOJYSKATK-SFHVURJKSA-N |