3-({[(oxolan-2-yl)methyl](thiophene-2-carbonyl)amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
Chemical Structure Depiction of
3-({[(oxolan-2-yl)methyl](thiophene-2-carbonyl)amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
3-({[(oxolan-2-yl)methyl](thiophene-2-carbonyl)amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
Compound characteristics
| Compound ID: | V028-1619 |
| Compound Name: | 3-({[(oxolan-2-yl)methyl](thiophene-2-carbonyl)amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate |
| Molecular Weight: | 506.04 |
| Molecular Formula: | C24 H24 Cl N O5 S2 |
| Smiles: | Cc1cccc(c1S(=O)(=O)Oc1cccc(CN(CC2CCCO2)C(c2cccs2)=O)c1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4732 |
| logD: | 4.4732 |
| logSw: | -4.4966 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.612 |
| InChI Key: | FHAGJAKIYRXQEM-HXUWFJFHSA-N |