2-{[(2-chloro-4-fluorophenyl)methanesulfonyl]methyl}-N-(3-ethoxypropyl)-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
Chemical Structure Depiction of
2-{[(2-chloro-4-fluorophenyl)methanesulfonyl]methyl}-N-(3-ethoxypropyl)-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
2-{[(2-chloro-4-fluorophenyl)methanesulfonyl]methyl}-N-(3-ethoxypropyl)-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
Compound characteristics
| Compound ID: | K784-7098 |
| Compound Name: | 2-{[(2-chloro-4-fluorophenyl)methanesulfonyl]methyl}-N-(3-ethoxypropyl)-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide |
| Molecular Weight: | 497.97 |
| Molecular Formula: | C22 H25 Cl F N3 O5 S |
| Smiles: | CCOCCCNC(c1ccc2c(c1)NC(C(CS(Cc1ccc(cc1[Cl])F)(=O)=O)N2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4234 |
| logD: | 2.423 |
| logSw: | -3.3751 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 97.902 |
| InChI Key: | BCNDWQHKQMZYFB-FQEVSTJZSA-N |