N-(5-{[(2-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide
Chemical Structure Depiction of
N-(5-{[(2-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide
N-(5-{[(2-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide
Compound characteristics
| Compound ID: | G072-2328 |
| Compound Name: | N-(5-{[(2-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide |
| Molecular Weight: | 443.57 |
| Molecular Formula: | C19 H17 N5 O2 S3 |
| Smiles: | CC1=CN2C(=NC(CSc3nnc(NC(CCc4ccccc4)=O)s3)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.4276 |
| logD: | 3.4217 |
| logSw: | -3.7654 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.225 |
| InChI Key: | VTPYJFOKDKQDGH-UHFFFAOYSA-N |