2-tert-butyl-7-({[(3,4-dimethoxyphenyl)methyl](2-methylpropyl)amino}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-tert-butyl-7-({[(3,4-dimethoxyphenyl)methyl](2-methylpropyl)amino}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-tert-butyl-7-({[(3,4-dimethoxyphenyl)methyl](2-methylpropyl)amino}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G768-3060 |
| Compound Name: | 2-tert-butyl-7-({[(3,4-dimethoxyphenyl)methyl](2-methylpropyl)amino}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 444.6 |
| Molecular Formula: | C23 H32 N4 O3 S |
| Smiles: | CC(C)CN(CC1=CC(N2C(=N1)SC(C(C)(C)C)=N2)=O)Cc1ccc(c(c1)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 3.7526 |
| logD: | 2.5107 |
| logSw: | -4.0369 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.515 |
| InChI Key: | KAIFHNGFOTZSHC-UHFFFAOYSA-N |