2-butyl-7-({[(4-fluorophenyl)methyl](2-methylpropyl)amino}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-butyl-7-({[(4-fluorophenyl)methyl](2-methylpropyl)amino}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-butyl-7-({[(4-fluorophenyl)methyl](2-methylpropyl)amino}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G768-2096 |
| Compound Name: | 2-butyl-7-({[(4-fluorophenyl)methyl](2-methylpropyl)amino}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 402.53 |
| Molecular Formula: | C21 H27 F N4 O S |
| Smiles: | CCCCC1=NN2C(=NC(CN(CC(C)C)Cc3ccc(cc3)F)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.7217 |
| logD: | 4.5665 |
| logSw: | -4.3618 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.158 |
| InChI Key: | UCUXQYJLZYUOPA-UHFFFAOYSA-N |