5-ethyl-5-methyl-3-(2-methylprop-2-en-1-yl)-2-sulfanylidene-2,3,5,6-tetrahydrobenzo[h]quinazolin-4(1H)-one
					Chemical Structure Depiction of
5-ethyl-5-methyl-3-(2-methylprop-2-en-1-yl)-2-sulfanylidene-2,3,5,6-tetrahydrobenzo[h]quinazolin-4(1H)-one
			5-ethyl-5-methyl-3-(2-methylprop-2-en-1-yl)-2-sulfanylidene-2,3,5,6-tetrahydrobenzo[h]quinazolin-4(1H)-one
Compound characteristics
| Compound ID: | D325-0750 | 
| Compound Name: | 5-ethyl-5-methyl-3-(2-methylprop-2-en-1-yl)-2-sulfanylidene-2,3,5,6-tetrahydrobenzo[h]quinazolin-4(1H)-one | 
| Molecular Weight: | 326.46 | 
| Molecular Formula: | C19 H22 N2 O S | 
| Smiles: | CCC1(C)Cc2ccccc2C2=C1C(N(CC(C)=C)C(N2)=S)=O | 
| Stereo: | RACEMIC MIXTURE | 
| logP: | 4.4044 | 
| logD: | 4.3779 | 
| logSw: | -4.2802 | 
| Hydrogen bond acceptors count: | 4 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 27.447 | 
| InChI Key: | HDZHPKHQORSVBR-IBGZPJMESA-N | 
 
				 
				