1-(allylamino)-3-((2-aminoethyl)amino)-7-benzyl-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile
TL;DR: 1-(allylamino)-3-((2-aminoethyl)amino)-7-benzyl-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile (CAS 302817-87-4) is a chemical compound with molecular formula C21H26N6 and molecular weight 362.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-aminoethylamino)-7-benzyl-1-(prop-2-enylamino)-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile
Also Known As: 1-(allylamino)-3-((2-aminoethyl)amino)-7-benzyl-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile, 3-(2-aminoethylamino)-7-benzyl-1-(prop-2-enylamino)-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile, 3-[(2-aminoethyl)amino]-7-benzyl-1-(prop-2-en-1-ylamino)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile
| Molecular Formula | C21H26N6 |
|---|---|
| Molecular Weight | 362.22 g/mol |
| LogP | 2.48008 |
| Topological Polar Surface Area | 90.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 362.2219 |
| Heavy Atoms | 27 |
| Complexity | 824.80084 |
Chemical Identifiers
| CAS Number | 302817-87-4 |
|---|---|
| SMILES | C=CCNC1=NC(=C(C2=C1CN(CC2)CC3=CC=CC=C3)C#N)NCCN |
Product Overview
1-(allylamino)-3-((2-aminoethyl)amino)-7-benzyl-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile (CAS 302817-87-4), with molecular formula C21H26N6 and molecular weight 362.22 g/mol. IUPAC: 3-(2-aminoethylamino)-7-benzyl-1-(prop-2-enylamino)-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile.
Chemical Property Profile of 1-(allylamino)-3-((2-aminoethyl)amino)-7-benzyl-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile
Property Insights of 1-(allylamino)-3-((2-aminoethyl)amino)-7-benzyl-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile
The XLogP value of 2.48008 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(allylamino)-3-((2-aminoethyl)amino)-7-benzyl-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile. The TPSA of 90.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(allylamino)-3-((2-aminoethyl)amino)-7-benzyl-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile. Following Lipinski's Rule of Five, 1-(allylamino)-3-((2-aminoethyl)amino)-7-benzyl-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile has 3 hydrogen bond donor(s) and 6 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 1-(allylamino)-3-((2-aminoethyl)amino)-7-benzyl-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile?
The CAS number of 1-(allylamino)-3-((2-aminoethyl)amino)-7-benzyl-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile is 302817-87-4.
What is the molecular formula of 1-(allylamino)-3-((2-aminoethyl)amino)-7-benzyl-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile?
The molecular formula of 1-(allylamino)-3-((2-aminoethyl)amino)-7-benzyl-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile is C21H26N6.
What is the molecular weight of 1-(allylamino)-3-((2-aminoethyl)amino)-7-benzyl-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile?
The molecular weight of 1-(allylamino)-3-((2-aminoethyl)amino)-7-benzyl-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile is 362.22 g/mol.
Where can I buy 1-(allylamino)-3-((2-aminoethyl)amino)-7-benzyl-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile?
You can request a quote for 1-(allylamino)-3-((2-aminoethyl)amino)-7-benzyl-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(allylamino)-3-((2-aminoethyl)amino)-7-benzyl-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 1-(allylamino)-3-((2-aminoethyl)amino)-7-benzyl-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.