4-{[(butan-2-yl)(furan-2-carbonyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate
Chemical Structure Depiction of
4-{[(butan-2-yl)(furan-2-carbonyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate
4-{[(butan-2-yl)(furan-2-carbonyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate
Compound characteristics
| Compound ID: | V025-5571 |
| Compound Name: | 4-{[(butan-2-yl)(furan-2-carbonyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate |
| Molecular Weight: | 461.96 |
| Molecular Formula: | C23 H24 Cl N O5 S |
| Smiles: | CCC(C)N(Cc1ccc(cc1)OS(c1c(C)cccc1[Cl])(=O)=O)C(c1ccco1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8595 |
| logD: | 4.8595 |
| logSw: | -4.815 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.118 |
| InChI Key: | MLEGMYDXUIPUHO-KRWDZBQOSA-N |