N''-(6-{[(4-methylphenyl)sulfanyl]methyl}-4-oxo-1,4-dihydropyrimidin-2-yl)-N-(naphthalen-1-yl)guanidine
Chemical Structure Depiction of
N''-(6-{[(4-methylphenyl)sulfanyl]methyl}-4-oxo-1,4-dihydropyrimidin-2-yl)-N-(naphthalen-1-yl)guanidine
N''-(6-{[(4-methylphenyl)sulfanyl]methyl}-4-oxo-1,4-dihydropyrimidin-2-yl)-N-(naphthalen-1-yl)guanidine
Compound characteristics
Compound ID: | 6186-3750 |
Compound Name: | N''-(6-{[(4-methylphenyl)sulfanyl]methyl}-4-oxo-1,4-dihydropyrimidin-2-yl)-N-(naphthalen-1-yl)guanidine |
Molecular Weight: | 415.52 |
Molecular Formula: | C23 H21 N5 O S |
Smiles: | Cc1ccc(cc1)SCC1=CC(N=C(N1)/N=C(\N)Nc1cccc2ccccc12)=O |
Stereo: | ACHIRAL |
logP: | 4.0989 |
logD: | 4.0989 |
logSw: | -4.3502 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 4 |
Polar surface area: | 72.76 |
InChI Key: | DQXPEMXPAQDDEG-UHFFFAOYSA-N |