7-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}-2-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}-2-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
7-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}-2-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | C679-2202 |
| Compound Name: | 7-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}-2-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 345.46 |
| Molecular Formula: | C15 H11 N3 O S3 |
| Smiles: | CC1=CN2C(=NC(CSc3nc4ccccc4s3)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.463 |
| logD: | 3.463 |
| logSw: | -3.6638 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 35.522 |
| InChI Key: | WHGVIVRJTSDDEQ-UHFFFAOYSA-N |