4-chloro-2-({[(furan-2-yl)methyl](thiophene-2-carbonyl)amino}methyl)phenyl 4-acetamidobenzene-1-sulfonate
Chemical Structure Depiction of
4-chloro-2-({[(furan-2-yl)methyl](thiophene-2-carbonyl)amino}methyl)phenyl 4-acetamidobenzene-1-sulfonate
4-chloro-2-({[(furan-2-yl)methyl](thiophene-2-carbonyl)amino}methyl)phenyl 4-acetamidobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V029-9767 |
| Compound Name: | 4-chloro-2-({[(furan-2-yl)methyl](thiophene-2-carbonyl)amino}methyl)phenyl 4-acetamidobenzene-1-sulfonate |
| Molecular Weight: | 545.03 |
| Molecular Formula: | C25 H21 Cl N2 O6 S2 |
| Smiles: | CC(Nc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1CN(Cc1ccco1)C(c1cccs1)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.6692 |
| logD: | 4.6691 |
| logSw: | -4.8044 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.055 |
| InChI Key: | APSVQXNHKFKYOQ-UHFFFAOYSA-N |