7-{[(4-methoxyphenyl)sulfanyl]methyl}-2-(3-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-{[(4-methoxyphenyl)sulfanyl]methyl}-2-(3-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-{[(4-methoxyphenyl)sulfanyl]methyl}-2-(3-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | C679-2633 |
| Compound Name: | 7-{[(4-methoxyphenyl)sulfanyl]methyl}-2-(3-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 395.5 |
| Molecular Formula: | C20 H17 N3 O2 S2 |
| Smiles: | Cc1cccc(c1)C1=NN2C(=NC(CSc3ccc(cc3)OC)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.4005 |
| logD: | 4.4003 |
| logSw: | -4.4676 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 45.543 |
| InChI Key: | GZKXKDLVKVGVNU-UHFFFAOYSA-N |