![methyl 4-(6-amino-3-(4-(benzyloxy)phenyl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoate structure](/static/products/877/877782-52-0.png)
methyl 4-(6-amino-3-(4-(benzyloxy)phenyl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoate
TL;DR: methyl 4-(6-amino-3-(4-(benzyloxy)phenyl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoate (CAS 877782-52-0) is a chemical compound with molecular formula C28H22N4O4 and molecular weight 478.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[6-amino-5-cyano-3-(4-phenylmethoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazol-4-yl]benzoate
Also Known As: methyl 4-(6-amino-3-(4-(benzyloxy)phenyl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoate, methyl 4-[6-amino-5-cyano-3-(4-phenylmethoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazol-4-yl]benzoate, methyl 4-{6-amino-3-[4-(benzyloxy)phenyl]-5-cyano-2,4-dihydropyrano[2,3-c]pyrazol-4-yl}benzoate
| Molecular Formula | C28H22N4O4 |
|---|---|
| Molecular Weight | 478.16 g/mol |
| LogP | 4.66048 |
| Topological Polar Surface Area | 123.25 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 478.1641 |
| Heavy Atoms | 36 |
| Complexity | 1466.981 |
Chemical Identifiers
| CAS Number | 877782-52-0 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)C2C(=C(OC3=NNC(=C23)C4=CC=C(C=C4)OCC5=CC=CC=C5)N)C#N |
Product Overview
methyl 4-(6-amino-3-(4-(benzyloxy)phenyl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoate (CAS 877782-52-0), with molecular formula C28H22N4O4 and molecular weight 478.16 g/mol. IUPAC: methyl 4-[6-amino-5-cyano-3-(4-phenylmethoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazol-4-yl]benzoate.
Chemical Property Profile of methyl 4-(6-amino-3-(4-(benzyloxy)phenyl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoate
Property Insights of methyl 4-(6-amino-3-(4-(benzyloxy)phenyl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoate
The XLogP value of 4.66048 indicates that methyl 4-(6-amino-3-(4-(benzyloxy)phenyl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 123.25 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 4-(6-amino-3-(4-(benzyloxy)phenyl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoate. Following Lipinski's Rule of Five, methyl 4-(6-amino-3-(4-(benzyloxy)phenyl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoate 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 methyl 4-(6-amino-3-(4-(benzyloxy)phenyl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoate?
The CAS number of methyl 4-(6-amino-3-(4-(benzyloxy)phenyl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoate is 877782-52-0.
What is the molecular formula of methyl 4-(6-amino-3-(4-(benzyloxy)phenyl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoate?
The molecular formula of methyl 4-(6-amino-3-(4-(benzyloxy)phenyl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoate is C28H22N4O4.
What is the molecular weight of methyl 4-(6-amino-3-(4-(benzyloxy)phenyl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoate?
The molecular weight of methyl 4-(6-amino-3-(4-(benzyloxy)phenyl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoate is 478.16 g/mol.
Where can I buy methyl 4-(6-amino-3-(4-(benzyloxy)phenyl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoate?
You can request a quote for methyl 4-(6-amino-3-(4-(benzyloxy)phenyl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 4-(6-amino-3-(4-(benzyloxy)phenyl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 4-(6-amino-3-(4-(benzyloxy)phenyl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.