4-{[N-cyclopropyl(2-methoxyphenyl)carbamamido]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate
Chemical Structure Depiction of
4-{[N-cyclopropyl(2-methoxyphenyl)carbamamido]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate
4-{[N-cyclopropyl(2-methoxyphenyl)carbamamido]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate
Compound characteristics
| Compound ID: | V027-3984 |
| Compound Name: | 4-{[N-cyclopropyl(2-methoxyphenyl)carbamamido]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate |
| Molecular Weight: | 501 |
| Molecular Formula: | C25 H25 Cl N2 O5 S |
| Smiles: | Cc1cccc(c1S(=O)(=O)Oc1ccc(CN(C2CC2)C(Nc2ccccc2OC)=O)cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.3606 |
| logD: | 5.3606 |
| logSw: | -5.8055 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.269 |
| InChI Key: | HSEHCMSFPWURMT-UHFFFAOYSA-N |