2-butyl-7-[(3,4-dihydroquinolin-1(2H)-yl)methyl]-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-butyl-7-[(3,4-dihydroquinolin-1(2H)-yl)methyl]-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-butyl-7-[(3,4-dihydroquinolin-1(2H)-yl)methyl]-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G072-0179 |
| Compound Name: | 2-butyl-7-[(3,4-dihydroquinolin-1(2H)-yl)methyl]-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 354.47 |
| Molecular Formula: | C19 H22 N4 O S |
| Smiles: | CCCCC1=NN2C(=NC(CN3CCCc4ccccc34)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.0935 |
| logD: | 4.0909 |
| logSw: | -4.0033 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.009 |
| InChI Key: | DRCXFPVKOVJSKB-UHFFFAOYSA-N |