2-(ethylsulfanyl)-5-(4-fluorophenyl)-8,8-dimethyl-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
					Chemical Structure Depiction of
2-(ethylsulfanyl)-5-(4-fluorophenyl)-8,8-dimethyl-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
			2-(ethylsulfanyl)-5-(4-fluorophenyl)-8,8-dimethyl-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Compound characteristics
| Compound ID: | C117-0158 | 
| Compound Name: | 2-(ethylsulfanyl)-5-(4-fluorophenyl)-8,8-dimethyl-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione | 
| Molecular Weight: | 399.49 | 
| Molecular Formula: | C21 H22 F N3 O2 S | 
| Smiles: | CCSC1NC(C2C(C3=C(CC(C)(C)CC3=O)NC=2N=1)c1ccc(cc1)F)=O | 
| Stereo: | RACEMIC MIXTURE | 
| logP: | 3.2479 | 
| logD: | 1.1735 | 
| logSw: | -3.4488 | 
| Hydrogen bond acceptors count: | 6 | 
| Hydrogen bond donors count: | 2 | 
| Polar surface area: | 57.622 | 
| InChI Key: | ZHEMLQJZRVXGTE-OAHLLOKOSA-N | 
 
				 
				