N-[(4-methoxyphenyl)methyl]-2-(methylsulfanyl)-4-propylpyrimidine-5-carboxamide
Chemical Structure Depiction of
N-[(4-methoxyphenyl)methyl]-2-(methylsulfanyl)-4-propylpyrimidine-5-carboxamide
N-[(4-methoxyphenyl)methyl]-2-(methylsulfanyl)-4-propylpyrimidine-5-carboxamide
Compound characteristics
Compound ID: | E727-1347 |
Compound Name: | N-[(4-methoxyphenyl)methyl]-2-(methylsulfanyl)-4-propylpyrimidine-5-carboxamide |
Molecular Weight: | 331.43 |
Molecular Formula: | C17 H21 N3 O2 S |
Smiles: | CCCc1c(cnc(n1)SC)C(NCc1ccc(cc1)OC)=O |
Stereo: | ACHIRAL |
logP: | 3.5215 |
logD: | 3.5215 |
logSw: | -3.6232 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 51.276 |
InChI Key: | AWQDZLZPKDHHEE-UHFFFAOYSA-N |