7-{4-[(2,4-dimethylphenoxy)acetyl]piperazin-1-yl}-2-(3-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-{4-[(2,4-dimethylphenoxy)acetyl]piperazin-1-yl}-2-(3-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-{4-[(2,4-dimethylphenoxy)acetyl]piperazin-1-yl}-2-(3-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | F529-0176 |
| Compound Name: | 7-{4-[(2,4-dimethylphenoxy)acetyl]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: | Cc1cccc(c1)C1=NN2C(=NC(=CC2=O)N2CCN(CC2)C(COc2ccc(C)cc2C)=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.9631 |
| logD: | 3.9543 |
| logSw: | -4.0246 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.883 |
| InChI Key: | MROSAYSPJVRWKM-UHFFFAOYSA-N |