7-{[benzyl(propyl)amino]methyl}-2-butyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-{[benzyl(propyl)amino]methyl}-2-butyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-{[benzyl(propyl)amino]methyl}-2-butyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
Compound ID: | G768-1922 |
Compound Name: | 7-{[benzyl(propyl)amino]methyl}-2-butyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
Molecular Weight: | 370.52 |
Molecular Formula: | C20 H26 N4 O S |
Smiles: | CCCCC1=NN2C(=NC(CN(CCC)Cc3ccccc3)=CC2=O)S1 |
Stereo: | ACHIRAL |
logP: | 4.2391 |
logD: | 3.9321 |
logSw: | -4.0642 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 42.136 |
InChI Key: | PWZASGKCQUWHCP-UHFFFAOYSA-N |