2-methoxy-N-(2-{[(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide
Chemical Structure Depiction of
2-methoxy-N-(2-{[(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide
2-methoxy-N-(2-{[(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide
Compound characteristics
| Compound ID: | G072-1848 |
| Compound Name: | 2-methoxy-N-(2-{[(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide |
| Molecular Weight: | 495.6 |
| Molecular Formula: | C22 H17 N5 O3 S3 |
| Smiles: | CC1=NN2C(=NC(CSc3nc4ccc(cc4s3)NC(c3ccccc3OC)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.3742 |
| logD: | 4.3604 |
| logSw: | -4.4754 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.247 |
| InChI Key: | FFNAPUGHNAZDOJ-UHFFFAOYSA-N |