3-benzyl-N-(3-chloro-4-fluorophenyl)-1,3-diazinane-1-carbothioamide
					Chemical Structure Depiction of
3-benzyl-N-(3-chloro-4-fluorophenyl)-1,3-diazinane-1-carbothioamide
			3-benzyl-N-(3-chloro-4-fluorophenyl)-1,3-diazinane-1-carbothioamide
Compound characteristics
| Compound ID: | K783-5176 | 
| Compound Name: | 3-benzyl-N-(3-chloro-4-fluorophenyl)-1,3-diazinane-1-carbothioamide | 
| Molecular Weight: | 363.88 | 
| Molecular Formula: | C18 H19 Cl F N3 S | 
| Smiles: | C1CN(Cc2ccccc2)CN(C1)C(Nc1ccc(c(c1)[Cl])F)=S | 
| Stereo: | ACHIRAL | 
| logP: | 4.7084 | 
| logD: | 4.5877 | 
| logSw: | -5.0688 | 
| Hydrogen bond acceptors count: | 3 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 15.4171 | 
| InChI Key: | YJQWGWFQHRARRD-UHFFFAOYSA-N | 
 
				 
				