![3-amino-9-oxo-9H-pyrrolo[1,2-a]indole-2-carbonitrile structure](/static/products/167/167954-15-6.webp)
3-amino-9-oxo-9H-pyrrolo[1,2-a]indole-2-carbonitrile
TL;DR: 3-amino-9-oxo-9H-pyrrolo[1,2-a]indole-2-carbonitrile (CAS 167954-15-6) is a chemical compound with molecular formula C12H7N3O and molecular weight 209.05891 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-amino-4-oxopyrrolo[1,2-a]indole-2-carbonitrile
Also Known As: 1-amino-4-oxopyrrolo[1,2-a]indole-2-carbonitrile, 3-amino-9-oxo-9H-pyrrolo[1,2-a]indole-2-carbonitrile, 3-amino-9-oxobenzo[b]pyrrolizine-2-carbonitrile, 3-amino-2-cyano-9-oxo-9h-pyrrolo[1,2-a]indole, AH-262/34227052
Technical Specifications
| Molecular Formula | C12H7N3O |
| Molecular Weight | 209.05891 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 71.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 209.05891 Da |
| Heavy Atoms | 16 |
| Complexity | 372.0 |
| SMILES | C1=CC=C2C(=C1)C(=O)C3=CC(=C(N23)N)C#N |
| InChIKey | PMHSXRNFAKCWNU-UHFFFAOYSA-N |
Chemical Property Profile of 3-amino-9-oxo-9H-pyrrolo[1,2-a]indole-2-carbonitrile
Property Insights of 3-amino-9-oxo-9H-pyrrolo[1,2-a]indole-2-carbonitrile
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-amino-9-oxo-9H-pyrrolo[1,2-a]indole-2-carbonitrile. The TPSA of 71.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-amino-9-oxo-9H-pyrrolo[1,2-a]indole-2-carbonitrile. Following Lipinski's Rule of Five, 3-amino-9-oxo-9H-pyrrolo[1,2-a]indole-2-carbonitrile has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-amino-9-oxo-9H-pyrrolo[1,2-a]indole-2-carbonitrile?
The CAS number of 3-amino-9-oxo-9H-pyrrolo[1,2-a]indole-2-carbonitrile is 167954-15-6.
What is the molecular formula of 3-amino-9-oxo-9H-pyrrolo[1,2-a]indole-2-carbonitrile?
The molecular formula of 3-amino-9-oxo-9H-pyrrolo[1,2-a]indole-2-carbonitrile is C12H7N3O.
What is the molecular weight of 3-amino-9-oxo-9H-pyrrolo[1,2-a]indole-2-carbonitrile?
The molecular weight of 3-amino-9-oxo-9H-pyrrolo[1,2-a]indole-2-carbonitrile is 209.05891 g/mol.
Where can I buy 3-amino-9-oxo-9H-pyrrolo[1,2-a]indole-2-carbonitrile?
You can request a quote for 3-amino-9-oxo-9H-pyrrolo[1,2-a]indole-2-carbonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-amino-9-oxo-9H-pyrrolo[1,2-a]indole-2-carbonitrile?
Yes, CoreyChem provides custom synthesis services for 3-amino-9-oxo-9H-pyrrolo[1,2-a]indole-2-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.