N-[(2-methoxyphenyl)methyl]-3-{[(4-methylphenyl)carbamothioyl]amino}-4-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)benzamide
					Chemical Structure Depiction of
N-[(2-methoxyphenyl)methyl]-3-{[(4-methylphenyl)carbamothioyl]amino}-4-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)benzamide
			N-[(2-methoxyphenyl)methyl]-3-{[(4-methylphenyl)carbamothioyl]amino}-4-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)benzamide
Compound characteristics
| Compound ID: | K786-0268 | 
| Compound Name: | N-[(2-methoxyphenyl)methyl]-3-{[(4-methylphenyl)carbamothioyl]amino}-4-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)benzamide | 
| Molecular Weight: | 593.75 | 
| Molecular Formula: | C34 H35 N5 O3 S | 
| Smiles: | Cc1ccc(cc1)NC(Nc1cc(ccc1N1CC2CC(C1)C1=CC=CC(N1C2)=O)C(NCc1ccccc1OC)=O)=S | 
| Stereo: | MIXTURE OF STEREOISOMERS | 
| logP: | 6.3752 | 
| logD: | 6.3751 | 
| logSw: | -5.5374 | 
| Hydrogen bond acceptors count: | 7 | 
| Hydrogen bond donors count: | 3 | 
| Polar surface area: | 69.257 | 
| InChI Key: | YHUKRLOUNZVMCI-UHFFFAOYSA-N | 
 
				 
				