3-{[(cyclopropylmethyl)(furan-2-carbonyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate
Chemical Structure Depiction of
3-{[(cyclopropylmethyl)(furan-2-carbonyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate
3-{[(cyclopropylmethyl)(furan-2-carbonyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate
Compound characteristics
| Compound ID: | V028-1640 |
| Compound Name: | 3-{[(cyclopropylmethyl)(furan-2-carbonyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate |
| Molecular Weight: | 459.95 |
| Molecular Formula: | C23 H22 Cl N O5 S |
| Smiles: | Cc1cccc(c1S(=O)(=O)Oc1cccc(CN(CC2CC2)C(c2ccco2)=O)c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.5806 |
| logD: | 4.5806 |
| logSw: | -4.6275 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.041 |
| InChI Key: | XRODSMRGTDDWQG-UHFFFAOYSA-N |