N-(2-ethoxyphenyl)-6-methyl-4-(4-methylphenyl)-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxamide
Chemical Structure Depiction of
N-(2-ethoxyphenyl)-6-methyl-4-(4-methylphenyl)-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxamide
N-(2-ethoxyphenyl)-6-methyl-4-(4-methylphenyl)-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxamide
Compound characteristics
Compound ID: | 3591-0029 |
Compound Name: | N-(2-ethoxyphenyl)-6-methyl-4-(4-methylphenyl)-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxamide |
Molecular Weight: | 381.5 |
Molecular Formula: | C21 H23 N3 O2 S |
Smiles: | CCOc1ccccc1NC(C1C(c2ccc(C)cc2)NC(NC=1C)=S)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.7729 |
logD: | 3.7593 |
logSw: | -3.9352 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 52.278 |
InChI Key: | OOXNZPYBQYCXAH-LJQANCHMSA-N |