N-(4-{[5-oxo-2-(pentan-3-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methoxy}phenyl)cyclohexanecarboxamide
Chemical Structure Depiction of
N-(4-{[5-oxo-2-(pentan-3-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methoxy}phenyl)cyclohexanecarboxamide
N-(4-{[5-oxo-2-(pentan-3-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methoxy}phenyl)cyclohexanecarboxamide
Compound characteristics
| Compound ID: | C679-5075 |
| Compound Name: | N-(4-{[5-oxo-2-(pentan-3-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methoxy}phenyl)cyclohexanecarboxamide |
| Molecular Weight: | 454.59 |
| Molecular Formula: | C24 H30 N4 O3 S |
| Smiles: | CCC(CC)C1=NN2C(=NC(COc3ccc(cc3)NC(C3CCCCC3)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.9479 |
| logD: | 4.9446 |
| logSw: | -4.4752 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.053 |
| InChI Key: | RUKMZYQVXLGRIN-UHFFFAOYSA-N |