N-hexyl-2-({[(2-methylphenyl)methyl]sulfanyl}methyl)-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
Chemical Structure Depiction of
N-hexyl-2-({[(2-methylphenyl)methyl]sulfanyl}methyl)-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
N-hexyl-2-({[(2-methylphenyl)methyl]sulfanyl}methyl)-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
Compound characteristics
Compound ID: | K784-1583 |
Compound Name: | N-hexyl-2-({[(2-methylphenyl)methyl]sulfanyl}methyl)-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide |
Molecular Weight: | 425.59 |
Molecular Formula: | C24 H31 N3 O2 S |
Smiles: | CCCCCCNC(c1ccc2c(c1)NC(C(CSCc1ccccc1C)N2)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 5.6445 |
logD: | 5.6441 |
logSw: | -5.227 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 61.624 |
InChI Key: | WZLPFVLMXKLLBZ-QFIPXVFZSA-N |