6-Methoxy-2,4-dimethylpyrrolo[1,2-a]pyrimidine-7,8-dicarbonitrile
TL;DR: 6-Methoxy-2,4-dimethylpyrrolo[1,2-a]pyrimidine-7,8-dicarbonitrile (CAS 212834-36-1) is a chemical compound with molecular formula C12H10N4O and molecular weight 226.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methoxy-2,4-dimethylpyrrolo[1,2-a]pyrimidine-7,8-dicarbonitrile
Also Known As: 6-Methoxy-2,4-dimethylpyrrolo[1,2-a]pyrimidine-7,8-dicarbonitrile, 6-Methoxy-2,4-dimethylpyrrolo[1,2-a]pyrimidine-7,8-dicarbonitrile #, Pyrrolo[1,2-a]pyrimidine-7,8-dicarbonitrile, 6-methoxy-2,4-dimethyl-
| Molecular Formula | C12H10N4O |
|---|---|
| Molecular Weight | 226.09 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 74.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 226.08546 |
| Heavy Atoms | 17 |
| Complexity | 392.0 |
Chemical Identifiers
| CAS Number | 212834-36-1 |
|---|---|
| SMILES | CC1=CC(=NC2=C(C(=C(N12)OC)C#N)C#N)C |
| InChIKey | STMAFVZJHMQLDN-UHFFFAOYSA-N |
Product Overview
6-Methoxy-2,4-dimethylpyrrolo[1,2-a]pyrimidine-7,8-dicarbonitrile (CAS 212834-36-1), with molecular formula C12H10N4O and molecular weight 226.09 g/mol. IUPAC: 6-methoxy-2,4-dimethylpyrrolo[1,2-a]pyrimidine-7,8-dicarbonitrile.
Chemical Property Profile of 6-Methoxy-2,4-dimethylpyrrolo[1,2-a]pyrimidine-7,8-dicarbonitrile
Property Insights of 6-Methoxy-2,4-dimethylpyrrolo[1,2-a]pyrimidine-7,8-dicarbonitrile
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Methoxy-2,4-dimethylpyrrolo[1,2-a]pyrimidine-7,8-dicarbonitrile. The TPSA of 74.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Methoxy-2,4-dimethylpyrrolo[1,2-a]pyrimidine-7,8-dicarbonitrile. Following Lipinski's Rule of Five, 6-Methoxy-2,4-dimethylpyrrolo[1,2-a]pyrimidine-7,8-dicarbonitrile has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-Methoxy-2,4-dimethylpyrrolo[1,2-a]pyrimidine-7,8-dicarbonitrile?
The CAS number of 6-Methoxy-2,4-dimethylpyrrolo[1,2-a]pyrimidine-7,8-dicarbonitrile is 212834-36-1.
What is the molecular formula of 6-Methoxy-2,4-dimethylpyrrolo[1,2-a]pyrimidine-7,8-dicarbonitrile?
The molecular formula of 6-Methoxy-2,4-dimethylpyrrolo[1,2-a]pyrimidine-7,8-dicarbonitrile is C12H10N4O.
What is the molecular weight of 6-Methoxy-2,4-dimethylpyrrolo[1,2-a]pyrimidine-7,8-dicarbonitrile?
The molecular weight of 6-Methoxy-2,4-dimethylpyrrolo[1,2-a]pyrimidine-7,8-dicarbonitrile is 226.09 g/mol.
Where can I buy 6-Methoxy-2,4-dimethylpyrrolo[1,2-a]pyrimidine-7,8-dicarbonitrile?
You can request a quote for 6-Methoxy-2,4-dimethylpyrrolo[1,2-a]pyrimidine-7,8-dicarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Methoxy-2,4-dimethylpyrrolo[1,2-a]pyrimidine-7,8-dicarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-Methoxy-2,4-dimethylpyrrolo[1,2-a]pyrimidine-7,8-dicarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.