1-{[(4-methylphenyl)methyl]sulfanyl}-N,4-bis(2-methylpropyl)-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide
					Chemical Structure Depiction of
1-{[(4-methylphenyl)methyl]sulfanyl}-N,4-bis(2-methylpropyl)-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide
			1-{[(4-methylphenyl)methyl]sulfanyl}-N,4-bis(2-methylpropyl)-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide
Compound characteristics
| Compound ID: | F472-0417 | 
| Compound Name: | 1-{[(4-methylphenyl)methyl]sulfanyl}-N,4-bis(2-methylpropyl)-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide | 
| Molecular Weight: | 477.63 | 
| Molecular Formula: | C26 H31 N5 O2 S | 
| Smiles: | CC(C)CNC(c1ccc2C(N(CC(C)C)c3nnc(n3c2c1)SCc1ccc(C)cc1)=O)=O | 
| Stereo: | ACHIRAL | 
| logP: | 4.6768 | 
| logD: | 4.6768 | 
| logSw: | -4.3046 | 
| Hydrogen bond acceptors count: | 7 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 64.268 | 
| InChI Key: | VJNVMGNYNPFSDX-UHFFFAOYSA-N | 
 
				 
				