7-({[(4-chlorophenyl)methyl](2-methylpropyl)amino}methyl)-2-cyclohexyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-({[(4-chlorophenyl)methyl](2-methylpropyl)amino}methyl)-2-cyclohexyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-({[(4-chlorophenyl)methyl](2-methylpropyl)amino}methyl)-2-cyclohexyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
Compound ID: | G768-2268 |
Compound Name: | 7-({[(4-chlorophenyl)methyl](2-methylpropyl)amino}methyl)-2-cyclohexyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
Molecular Weight: | 445.03 |
Molecular Formula: | C23 H29 Cl N4 O S |
Smiles: | CC(C)CN(CC1=CC(N2C(=N1)SC(C1CCCCC1)=N2)=O)Cc1ccc(cc1)[Cl] |
Stereo: | ACHIRAL |
logP: | 5.7566 |
logD: | 5.6427 |
logSw: | -5.8803 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 42.175 |
InChI Key: | PBRHNEVZVVVADZ-UHFFFAOYSA-N |