rel-(3aR,6aS)-1-(2,5-dimethylphenyl)-3-[(3-nitrophenyl)methyl]tetrahydro-5lambda~6~-thieno[3,4-d]imidazole-2,5,5(1H,3H)-trione
					Chemical Structure Depiction of
rel-(3aR,6aS)-1-(2,5-dimethylphenyl)-3-[(3-nitrophenyl)methyl]tetrahydro-5lambda~6~-thieno[3,4-d]imidazole-2,5,5(1H,3H)-trione
			rel-(3aR,6aS)-1-(2,5-dimethylphenyl)-3-[(3-nitrophenyl)methyl]tetrahydro-5lambda~6~-thieno[3,4-d]imidazole-2,5,5(1H,3H)-trione
Compound characteristics
| Compound ID: | C200-4827 | 
| Compound Name: | rel-(3aR,6aS)-1-(2,5-dimethylphenyl)-3-[(3-nitrophenyl)methyl]tetrahydro-5lambda~6~-thieno[3,4-d]imidazole-2,5,5(1H,3H)-trione | 
| Molecular Weight: | 415.47 | 
| Molecular Formula: | C20 H21 N3 O5 S | 
| Smiles: | Cc1ccc(C)c(c1)N1C(N(Cc2cccc(c2)[N+]([O-])=O)[C@@H]2CS(C[C@H]12)(=O)=O)=O | 
| Stereo: | RACEMIC MIXTURE (RELATIVE) | 
| logP: | 2.7641 | 
| logD: | 2.7641 | 
| logSw: | -3.1207 | 
| Hydrogen bond acceptors count: | 10 | 
| Polar surface area: | 79.654 | 
| InChI Key: | AOOXXOIQBKJCRJ-UHFFFAOYSA-N | 
 
				 
				