3-methyl-N-(2-{[(3-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)butanamide
Chemical Structure Depiction of
3-methyl-N-(2-{[(3-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)butanamide
3-methyl-N-(2-{[(3-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)butanamide
Compound characteristics
| Compound ID: | G072-2170 |
| Compound Name: | 3-methyl-N-(2-{[(3-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)butanamide |
| Molecular Weight: | 444.59 |
| Molecular Formula: | C20 H20 N4 O2 S3 |
| Smiles: | CC(C)CC(Nc1ccc2c(c1)sc(n2)SCC1=CC(N2C(C)=CSC2=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2912 |
| logD: | 4.2911 |
| logSw: | -4.2718 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.818 |
| InChI Key: | XUQAHJGLLATKND-UHFFFAOYSA-N |