2-{[acetyl(cyclopropylmethyl)amino]methyl}-5-(diethylamino)phenyl 3,4-dichlorobenzene-1-sulfonate
Chemical Structure Depiction of
2-{[acetyl(cyclopropylmethyl)amino]methyl}-5-(diethylamino)phenyl 3,4-dichlorobenzene-1-sulfonate
2-{[acetyl(cyclopropylmethyl)amino]methyl}-5-(diethylamino)phenyl 3,4-dichlorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V031-1932 |
| Compound Name: | 2-{[acetyl(cyclopropylmethyl)amino]methyl}-5-(diethylamino)phenyl 3,4-dichlorobenzene-1-sulfonate |
| Molecular Weight: | 499.46 |
| Molecular Formula: | C23 H28 Cl2 N2 O4 S |
| Smiles: | CCN(CC)c1ccc(CN(CC2CC2)C(C)=O)c(c1)OS(c1ccc(c(c1)[Cl])[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3873 |
| logD: | 5.3766 |
| logSw: | -5.9453 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.025 |
| InChI Key: | MCGZLSRZGHJGSA-UHFFFAOYSA-N |