7-({benzyl[(3,4,5-trimethoxyphenyl)methyl]amino}methyl)-2-ethyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-({benzyl[(3,4,5-trimethoxyphenyl)methyl]amino}methyl)-2-ethyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-({benzyl[(3,4,5-trimethoxyphenyl)methyl]amino}methyl)-2-ethyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G768-3365 |
| Compound Name: | 7-({benzyl[(3,4,5-trimethoxyphenyl)methyl]amino}methyl)-2-ethyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 480.59 |
| Molecular Formula: | C25 H28 N4 O4 S |
| Smiles: | CCC1=NN2C(=NC(CN(Cc3ccccc3)Cc3cc(c(c(c3)OC)OC)OC)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.5966 |
| logD: | 2.098 |
| logSw: | -3.7278 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.864 |
| InChI Key: | XBYTVIXBWQLIJD-UHFFFAOYSA-N |