methyl 4-{[(4-oxo-3,4,5,6,7,8-hexahydroquinazolin-2-yl)sulfanyl]methyl}benzoate
					Chemical Structure Depiction of
methyl 4-{[(4-oxo-3,4,5,6,7,8-hexahydroquinazolin-2-yl)sulfanyl]methyl}benzoate
			methyl 4-{[(4-oxo-3,4,5,6,7,8-hexahydroquinazolin-2-yl)sulfanyl]methyl}benzoate
Compound characteristics
| Compound ID: | D365-0132 | 
| Compound Name: | methyl 4-{[(4-oxo-3,4,5,6,7,8-hexahydroquinazolin-2-yl)sulfanyl]methyl}benzoate | 
| Molecular Weight: | 330.4 | 
| Molecular Formula: | C17 H18 N2 O3 S | 
| Smiles: | COC(c1ccc(CSC2NC(C3CCCCC=3N=2)=O)cc1)=O | 
| Stereo: | ACHIRAL | 
| logP: | 2.5729 | 
| logD: | 2.4318 | 
| logSw: | -2.8679 | 
| Hydrogen bond acceptors count: | 7 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 55.646 | 
| InChI Key: | WWPDJIUMWGAFTL-UHFFFAOYSA-N | 
 
				 
				