(11aR)-1,2,3,10,11,11a-Hexahydro-5H-Pyrrolo[2,1-c][1,4]Benzodiazepin-5,11-Dione

Base Information

• Chemical Name: (11aR)-1,2,3,10,11,11a-Hexahydro-5H-Pyrrolo[2,1-c][1,4]Benzodiazepin-5,11-Dione
• CAS No.: 154802-75-2
• Molecular Formula: C₁₂H₁₂N₂O₂
• Molecular Weight: 216.239
• DSSTox Substance ID: DTXSID701141985
• ChEMBL ID: CHEMBL233670

Synonyms:CHEMBL233670;SCHEMBL7709727;DTXSID701141985;AKOS000773647;AKOS015911930;(11Ar)-Pyrrolo[2,1-C][1,4]Benzodiazepine;SR-01000375344;SR-01000375344-1;(11aR)-1,2,3,10,11,11a-Hexahydro-5H-Pyrrolo[2,1-c][1,4]Benzodiazepin-5,11-Dione;(11aR)-2,3-Dihydro-1H-pyrrolo[2,1-c][1,4]benzodiazepine-5,11(10H,11aH)-dione;154802-75-2

Chemical Property of (11aR)-1,2,3,10,11,11a-Hexahydro-5H-Pyrrolo[2,1-c][1,4]Benzodiazepin-5,11-Dione

Chemical Property:

• XLogP3: 0.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 216.089877630
• Heavy Atom Count: 16
• Complexity: 329

Purity/Quality:

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: C1CC2C(=O)NC3=CC=CC=C3C(=O)N2C1
• Isomeric SMILES: C1C[C@@H]2C(=O)NC3=CC=CC=C3C(=O)N2C1

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