4-({[2-(dimethylamino)ethyl](furan-2-carbonyl)amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
Chemical Structure Depiction of
4-({[2-(dimethylamino)ethyl](furan-2-carbonyl)amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
4-({[2-(dimethylamino)ethyl](furan-2-carbonyl)amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
Compound characteristics
| Compound ID: | V030-5583 |
| Compound Name: | 4-({[2-(dimethylamino)ethyl](furan-2-carbonyl)amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate |
| Molecular Weight: | 476.98 |
| Molecular Formula: | C23 H25 Cl N2 O5 S |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1S(=O)(=O)Oc1ccc(CN(CCN(C)C)C(c2ccco2)=O)cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.521 |
| logD: | 2.9838 |
| logSw: | -3.6603 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.633 |
| InChI Key: | IMLRMNSMBCYRAQ-UHFFFAOYSA-N |