2-ethyl-7-({(2-methylpropyl)[(3,4,5-trimethoxyphenyl)methyl]amino}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-ethyl-7-({(2-methylpropyl)[(3,4,5-trimethoxyphenyl)methyl]amino}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-ethyl-7-({(2-methylpropyl)[(3,4,5-trimethoxyphenyl)methyl]amino}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G768-3220 |
| Compound Name: | 2-ethyl-7-({(2-methylpropyl)[(3,4,5-trimethoxyphenyl)methyl]amino}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 446.57 |
| Molecular Formula: | C22 H30 N4 O4 S |
| Smiles: | CCC1=NN2C(=NC(CN(CC(C)C)Cc3cc(c(c(c3)OC)OC)OC)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.3778 |
| logD: | 0.7137 |
| logSw: | -3.6492 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.135 |
| InChI Key: | SXKZFKWPYJGCSZ-UHFFFAOYSA-N |