2-tert-butyl-7-({[(4-ethoxyphenyl)methyl](propyl)amino}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-tert-butyl-7-({[(4-ethoxyphenyl)methyl](propyl)amino}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-tert-butyl-7-({[(4-ethoxyphenyl)methyl](propyl)amino}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G768-3466 |
| Compound Name: | 2-tert-butyl-7-({[(4-ethoxyphenyl)methyl](propyl)amino}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 414.57 |
| Molecular Formula: | C22 H30 N4 O2 S |
| Smiles: | CCCN(CC1=CC(N2C(=N1)SC(C(C)(C)C)=N2)=O)Cc1ccc(cc1)OCC |
| Stereo: | ACHIRAL |
| logP: | 4.0949 |
| logD: | 3.9008 |
| logSw: | -3.9481 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.356 |
| InChI Key: | AJYFIVQFZNMHDA-UHFFFAOYSA-N |