7-{4-[2-(3-methylphenoxy)propanoyl]piperazin-1-yl}-2-(3-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-{4-[2-(3-methylphenoxy)propanoyl]piperazin-1-yl}-2-(3-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-{4-[2-(3-methylphenoxy)propanoyl]piperazin-1-yl}-2-(3-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | F529-0193 |
| Compound Name: | 7-{4-[2-(3-methylphenoxy)propanoyl]piperazin-1-yl}-2-(3-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 489.6 |
| Molecular Formula: | C26 H27 N5 O3 S |
| Smiles: | CC(C(N1CCN(CC1)C1=CC(N2C(=N1)SC(c1cccc(C)c1)=N2)=O)=O)Oc1cccc(C)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9229 |
| logD: | 3.9141 |
| logSw: | -3.9346 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.614 |
| InChI Key: | LGOHGESFJHLTEJ-IBGZPJMESA-N |