4-tert-butyl-N-(5-{[(5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
Chemical Structure Depiction of
4-tert-butyl-N-(5-{[(5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
4-tert-butyl-N-(5-{[(5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
Compound characteristics
| Compound ID: | G072-2135 |
| Compound Name: | 4-tert-butyl-N-(5-{[(5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide |
| Molecular Weight: | 457.59 |
| Molecular Formula: | C20 H19 N5 O2 S3 |
| Smiles: | CC(C)(C)c1ccc(cc1)C(Nc1nnc(SCC2=CC(N3C=CSC3=N2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3952 |
| logD: | 4.3391 |
| logSw: | -4.2523 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.919 |
| InChI Key: | SPICENICMKQXEN-UHFFFAOYSA-N |