2-methyl-7-({[5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-methyl-7-({[5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
2-methyl-7-({[5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G072-0417 |
| Compound Name: | 2-methyl-7-({[5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 369.46 |
| Molecular Formula: | C17 H15 N5 O S2 |
| Smiles: | CC1=CN2C(=NC(CSc3nnc(c4ccc(C)cc4)[nH]3)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 2.5478 |
| logD: | 1.3713 |
| logSw: | -2.6667 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.948 |
| InChI Key: | JAOZUZOPUHBEIL-UHFFFAOYSA-N |