7-[(benzyl{[4-(propan-2-yl)phenyl]methyl}amino)methyl]-2-ethyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-[(benzyl{[4-(propan-2-yl)phenyl]methyl}amino)methyl]-2-ethyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-[(benzyl{[4-(propan-2-yl)phenyl]methyl}amino)methyl]-2-ethyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G768-3713 |
| Compound Name: | 7-[(benzyl{[4-(propan-2-yl)phenyl]methyl}amino)methyl]-2-ethyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 432.59 |
| Molecular Formula: | C25 H28 N4 O S |
| Smiles: | CCC1=NN2C(=NC(CN(Cc3ccccc3)Cc3ccc(cc3)C(C)C)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 5.2734 |
| logD: | 5.1776 |
| logSw: | -5.1261 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.886 |
| InChI Key: | MAHQELQUGTYEFY-UHFFFAOYSA-N |