J3.689.010J
TL;DR: J3.689.010J (CAS 353468-39-0) is a chemical compound with molecular formula C17H18N4O4 and molecular weight 342.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-3-methyl-4-(2,4,6-trimethoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Also Known As: J3.689.010J, 6-amino-3-methyl-4-(2,4,6-trimethoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-3-methyl-4-(2,4,6-trimethoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile, A2328/0098224, 6-amino-3-methyl-4-(2,4,6-trimethoxyphenyl)-1H,4H-pyrano[2,3-c]pyrazole-5-carbonitrile
| Molecular Formula | C17H18N4O4 |
|---|---|
| Molecular Weight | 342.13 g/mol |
| LogP | 1.9621 |
| Topological Polar Surface Area | 115.41 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 342.1328 |
| Heavy Atoms | 25 |
| Complexity | 869.5333 |
Chemical Identifiers
| CAS Number | 353468-39-0 |
|---|---|
| SMILES | CC1=C2C(C(=C(OC2=NN1)N)C#N)C3=C(C=C(C=C3OC)OC)OC |
Product Overview
J3.689.010J (CAS 353468-39-0), with molecular formula C17H18N4O4 and molecular weight 342.13 g/mol. IUPAC: 6-amino-3-methyl-4-(2,4,6-trimethoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile.
Chemical Property Profile of J3.689.010J
Property Insights of J3.689.010J
The XLogP value of 1.9621 suggests moderate lipophilicity, balancing water solubility and membrane permeability for J3.689.010J. The TPSA of 115.41 Ų falls within the moderate polarity range, balancing permeability and solubility for J3.689.010J. Following Lipinski's Rule of Five, J3.689.010J has 2 hydrogen bond donor(s) and 7 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 J3.689.010J?
The CAS number of J3.689.010J is 353468-39-0.
What is the molecular formula of J3.689.010J?
The molecular formula of J3.689.010J is C17H18N4O4.
What is the molecular weight of J3.689.010J?
The molecular weight of J3.689.010J is 342.13 g/mol.
Where can I buy J3.689.010J?
You can request a quote for J3.689.010J directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for J3.689.010J?
Yes, KEHONG BIO provides custom synthesis services for J3.689.010J and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.