2-{[(2-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}benzoic acid
Chemical Structure Depiction of
2-{[(2-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}benzoic acid
2-{[(2-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}benzoic acid
Compound characteristics
| Compound ID: | C679-2199 |
| Compound Name: | 2-{[(2-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}benzoic acid |
| Molecular Weight: | 332.4 |
| Molecular Formula: | C15 H12 N2 O3 S2 |
| Smiles: | CC1=CN2C(=NC(CSc3ccccc3C(O)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 2.2309 |
| logD: | -0.3805 |
| logSw: | -2.5673 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.849 |
| InChI Key: | ZCDYTXFTGQRZGI-UHFFFAOYSA-N |