Rac1-IN-3
TL;DR: Rac1-IN-3 (CAS 380470-06-4) is a chemical compound with molecular formula C21H23N7O2 and molecular weight 405.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,8-diamino-6-methoxy-3-[4-(2-methoxyphenyl)piperazin-1-yl]-2,7-naphthyridine-4-carbonitrile
Also Known As: Rac1-IN-3, 1,8-diamino-6-methoxy-3-(4-(2-methoxyphenyl)piperazin-1-yl)-2,7-naphthyridine-4-carbonitrile, 1,8-diamino-6-methoxy-3-[4-(2-methoxyphenyl)piperazin-1-yl]-2,7-naphthyridine-4-carbonitrile, 1,8-diamino-6-methoxy-3-[4-(2-methoxyphenyl)-1-piperazinyl]-2,7-naphthyridine-4-carbonitrile, 2,7-Naphthyridine-4-carbonitrile,1,8-diamino-6-methoxy-3-[4-(2-methoxyphenyl)-1-piperazinyl]-
| Molecular Formula | C21H23N7O2 |
|---|---|
| Molecular Weight | 405.19 g/mol |
| LogP | 2.00968 |
| Topological Polar Surface Area | 126.55 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 405.1913 |
| Heavy Atoms | 30 |
| Complexity | 1134.3835 |
Chemical Identifiers
| CAS Number | 380470-06-4 |
|---|---|
| SMILES | COC1=CC=CC=C1N2CCN(CC2)C3=C(C4=CC(=NC(=C4C(=N3)N)N)OC)C#N |
Product Overview
Rac1-IN-3 (CAS 380470-06-4), with molecular formula C21H23N7O2 and molecular weight 405.19 g/mol. IUPAC: 1,8-diamino-6-methoxy-3-[4-(2-methoxyphenyl)piperazin-1-yl]-2,7-naphthyridine-4-carbonitrile.
Chemical Property Profile of Rac1-IN-3
Property Insights of Rac1-IN-3
The XLogP value of 2.00968 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Rac1-IN-3. The TPSA of 126.55 Ų falls within the moderate polarity range, balancing permeability and solubility for Rac1-IN-3. Following Lipinski's Rule of Five, Rac1-IN-3 has 2 hydrogen bond donor(s) and 9 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 Rac1-IN-3?
The CAS number of Rac1-IN-3 is 380470-06-4.
What is the molecular formula of Rac1-IN-3?
The molecular formula of Rac1-IN-3 is C21H23N7O2.
What is the molecular weight of Rac1-IN-3?
The molecular weight of Rac1-IN-3 is 405.19 g/mol.
Where can I buy Rac1-IN-3?
You can request a quote for Rac1-IN-3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Rac1-IN-3?
Yes, KEHONG BIO provides custom synthesis services for Rac1-IN-3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.