![2-Imino-5-oxo-1-(2-phenylethyl)dipyrido[1,2-d:3',4'-f]pyrimidine-3-carbonitrile structure](/static/products/3333/333325-08-9.webp)
2-Imino-5-oxo-1-(2-phenylethyl)dipyrido[1,2-d:3',4'-f]pyrimidine-3-carbonitrile
TL;DR: 2-Imino-5-oxo-1-(2-phenylethyl)dipyrido[1,2-d:3',4'-f]pyrimidine-3-carbonitrile (CAS 333325-08-9) is a chemical compound with molecular formula C20H15N5O and molecular weight 341.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-imino-2-oxo-7-(2-phenylethyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carbonitrile
Also Known As: 2-imino-5-oxo-1-(2-phenylethyl)dipyrido[1,2-d:3',4'-f]pyrimidine-3-carbonitrile, 2-imino-5-oxo-1-(2-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile, 2-IMINO-5-OXO-1-(2-PHENYLETHYL)-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDINE-3-CARBONITRILE, 2-imino-5-oxo-1-phenethyl-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile
| Molecular Formula | C20H15N5O |
|---|---|
| Molecular Weight | 341.13 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 83.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 341.12766 |
| Heavy Atoms | 26 |
| Complexity | 858.0 |
Chemical Identifiers
| CAS Number | 333325-08-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCN2C3=C(C=C(C2=N)C#N)C(=O)N4C=CC=CC4=N3 |
| InChIKey | GCRZDZKWKPIVGJ-UHFFFAOYSA-N |
Product Overview
2-Imino-5-oxo-1-(2-phenylethyl)dipyrido[1,2-d:3',4'-f]pyrimidine-3-carbonitrile (CAS 333325-08-9), with molecular formula C20H15N5O and molecular weight 341.13 g/mol. IUPAC: 6-imino-2-oxo-7-(2-phenylethyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carbonitrile.
Chemical Property Profile of 2-Imino-5-oxo-1-(2-phenylethyl)dipyrido[1,2-d:3',4'-f]pyrimidine-3-carbonitrile
Property Insights of 2-Imino-5-oxo-1-(2-phenylethyl)dipyrido[1,2-d:3',4'-f]pyrimidine-3-carbonitrile
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Imino-5-oxo-1-(2-phenylethyl)dipyrido[1,2-d:3',4'-f]pyrimidine-3-carbonitrile. The TPSA of 83.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Imino-5-oxo-1-(2-phenylethyl)dipyrido[1,2-d:3',4'-f]pyrimidine-3-carbonitrile. Following Lipinski's Rule of Five, 2-Imino-5-oxo-1-(2-phenylethyl)dipyrido[1,2-d:3',4'-f]pyrimidine-3-carbonitrile has 1 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 2-Imino-5-oxo-1-(2-phenylethyl)dipyrido[1,2-d:3',4'-f]pyrimidine-3-carbonitrile?
The CAS number of 2-Imino-5-oxo-1-(2-phenylethyl)dipyrido[1,2-d:3',4'-f]pyrimidine-3-carbonitrile is 333325-08-9.
What is the molecular formula of 2-Imino-5-oxo-1-(2-phenylethyl)dipyrido[1,2-d:3',4'-f]pyrimidine-3-carbonitrile?
The molecular formula of 2-Imino-5-oxo-1-(2-phenylethyl)dipyrido[1,2-d:3',4'-f]pyrimidine-3-carbonitrile is C20H15N5O.
What is the molecular weight of 2-Imino-5-oxo-1-(2-phenylethyl)dipyrido[1,2-d:3',4'-f]pyrimidine-3-carbonitrile?
The molecular weight of 2-Imino-5-oxo-1-(2-phenylethyl)dipyrido[1,2-d:3',4'-f]pyrimidine-3-carbonitrile is 341.13 g/mol.
Where can I buy 2-Imino-5-oxo-1-(2-phenylethyl)dipyrido[1,2-d:3',4'-f]pyrimidine-3-carbonitrile?
You can request a quote for 2-Imino-5-oxo-1-(2-phenylethyl)dipyrido[1,2-d:3',4'-f]pyrimidine-3-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Imino-5-oxo-1-(2-phenylethyl)dipyrido[1,2-d:3',4'-f]pyrimidine-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Imino-5-oxo-1-(2-phenylethyl)dipyrido[1,2-d:3',4'-f]pyrimidine-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.