2-ethyl-7-{[ethyl(4-methoxyphenyl)amino]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-ethyl-7-{[ethyl(4-methoxyphenyl)amino]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-ethyl-7-{[ethyl(4-methoxyphenyl)amino]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G072-0106 |
| Compound Name: | 2-ethyl-7-{[ethyl(4-methoxyphenyl)amino]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 344.43 |
| Molecular Formula: | C17 H20 N4 O2 S |
| Smiles: | CCC1=NN2C(=NC(CN(CC)c3ccc(cc3)OC)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.2048 |
| logD: | 3.1866 |
| logSw: | -3.3812 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.729 |
| InChI Key: | IQCWFTXNQXVDGI-UHFFFAOYSA-N |