N-(2-methylcyclohexyl)-3-(4-oxo-2-sulfanylidene-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)propanamide
Chemical Structure Depiction of
N-(2-methylcyclohexyl)-3-(4-oxo-2-sulfanylidene-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)propanamide
N-(2-methylcyclohexyl)-3-(4-oxo-2-sulfanylidene-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)propanamide
Compound characteristics
| Compound ID: | K292-1826 |
| Compound Name: | N-(2-methylcyclohexyl)-3-(4-oxo-2-sulfanylidene-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)propanamide |
| Molecular Weight: | 351.49 |
| Molecular Formula: | C16 H21 N3 O2 S2 |
| Smiles: | CC1CCCCC1NC(CCN1C(c2c(ccs2)NC1=S)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.9955 |
| logD: | 2.9948 |
| logSw: | -3.5895 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.902 |
| InChI Key: | MBQRRKZNBDQGIR-UHFFFAOYSA-N |