3-methyl-7-{[(5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]methyl}-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
3-methyl-7-{[(5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]methyl}-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
3-methyl-7-{[(5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]methyl}-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G808-0059 |
| Compound Name: | 3-methyl-7-{[(5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]methyl}-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 380.45 |
| Molecular Formula: | C17 H12 N6 O S2 |
| Smiles: | CC1=CSC2=NC(CSc3nc4c(c5ccccc5[nH]4)nn3)=CC(N12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0527 |
| logD: | 2.0527 |
| logSw: | -2.5857 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.155 |
| InChI Key: | FKXVAPQOCBBLNU-UHFFFAOYSA-N |