N-(5-{[(5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclohexanecarboxamide
Chemical Structure Depiction of
N-(5-{[(5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclohexanecarboxamide
N-(5-{[(5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclohexanecarboxamide
Compound characteristics
| Compound ID: | G072-2111 |
| Compound Name: | N-(5-{[(5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclohexanecarboxamide |
| Molecular Weight: | 407.53 |
| Molecular Formula: | C16 H17 N5 O2 S3 |
| Smiles: | C1CCC(CC1)C(Nc1nnc(SCC2=CC(N3C=CSC3=N2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.783 |
| logD: | 2.7765 |
| logSw: | -3.1033 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.111 |
| InChI Key: | XGTYMRUWJBSTEV-UHFFFAOYSA-N |