2-cyclopropyl-7-({propyl[(3,4,5-trimethoxyphenyl)methyl]amino}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-cyclopropyl-7-({propyl[(3,4,5-trimethoxyphenyl)methyl]amino}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-cyclopropyl-7-({propyl[(3,4,5-trimethoxyphenyl)methyl]amino}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G768-3195 |
| Compound Name: | 2-cyclopropyl-7-({propyl[(3,4,5-trimethoxyphenyl)methyl]amino}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 444.55 |
| Molecular Formula: | C22 H28 N4 O4 S |
| Smiles: | CCCN(CC1=CC(N2C(=N1)SC(C1CC1)=N2)=O)Cc1cc(c(c(c1)OC)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 3.1734 |
| logD: | 0.5279 |
| logSw: | -3.3242 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.462 |
| InChI Key: | KNMYBDAZQRIURS-UHFFFAOYSA-N |