![6'-amino-7-bromo-3',5-dimethyl-2-oxo-1'-phenylspiro[1H-indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile structure](/static/products/7012/701252-17-7.webp)
6'-amino-7-bromo-3',5-dimethyl-2-oxo-1'-phenylspiro[1H-indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
TL;DR: 6'-amino-7-bromo-3',5-dimethyl-2-oxo-1'-phenylspiro[1H-indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile (CAS 701252-17-7) is a chemical compound with molecular formula C22H16BrN5O2 and molecular weight 461.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6'-amino-7-bromo-3',5-dimethyl-2-oxo-1'-phenylspiro[1H-indole-3,4'-pyrano[3,2-d]pyrazole]-5'-carbonitrile
Also Known As: 6'-amino-7-bromo-3',5-dimethyl-2-oxo-1'-phenylspiro[1H-indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile, 6'-amino-7-bromo-3',5-dimethyl-2-oxo-1'-phenyl-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
| Molecular Formula | C22H16BrN5O2 |
|---|---|
| Molecular Weight | 461.05 g/mol |
| LogP | 3.57612 |
| Topological Polar Surface Area | 105.96 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 461.04874 |
| Heavy Atoms | 30 |
| Complexity | 1319.5312 |
Chemical Identifiers
| CAS Number | 701252-17-7 |
|---|---|
| SMILES | CC1=CC2=C(C(=C1)Br)NC(=O)C23C(=C(OC4=C3C(=NN4C5=CC=CC=C5)C)N)C#N |
Product Overview
6'-amino-7-bromo-3',5-dimethyl-2-oxo-1'-phenylspiro[1H-indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile (CAS 701252-17-7), with molecular formula C22H16BrN5O2 and molecular weight 461.05 g/mol. IUPAC: 6'-amino-7-bromo-3',5-dimethyl-2-oxo-1'-phenylspiro[1H-indole-3,4'-pyrano[3,2-d]pyrazole]-5'-carbonitrile.
Chemical Property Profile of 6'-amino-7-bromo-3',5-dimethyl-2-oxo-1'-phenylspiro[1H-indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
Property Insights of 6'-amino-7-bromo-3',5-dimethyl-2-oxo-1'-phenylspiro[1H-indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
The XLogP value of 3.57612 indicates that 6'-amino-7-bromo-3',5-dimethyl-2-oxo-1'-phenylspiro[1H-indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.96 Ų falls within the moderate polarity range, balancing permeability and solubility for 6'-amino-7-bromo-3',5-dimethyl-2-oxo-1'-phenylspiro[1H-indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile. Following Lipinski's Rule of Five, 6'-amino-7-bromo-3',5-dimethyl-2-oxo-1'-phenylspiro[1H-indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile has 2 hydrogen bond donor(s) and 5 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 6'-amino-7-bromo-3',5-dimethyl-2-oxo-1'-phenylspiro[1H-indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile?
The CAS number of 6'-amino-7-bromo-3',5-dimethyl-2-oxo-1'-phenylspiro[1H-indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile is 701252-17-7.
What is the molecular formula of 6'-amino-7-bromo-3',5-dimethyl-2-oxo-1'-phenylspiro[1H-indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile?
The molecular formula of 6'-amino-7-bromo-3',5-dimethyl-2-oxo-1'-phenylspiro[1H-indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile is C22H16BrN5O2.
What is the molecular weight of 6'-amino-7-bromo-3',5-dimethyl-2-oxo-1'-phenylspiro[1H-indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile?
The molecular weight of 6'-amino-7-bromo-3',5-dimethyl-2-oxo-1'-phenylspiro[1H-indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile is 461.05 g/mol.
Where can I buy 6'-amino-7-bromo-3',5-dimethyl-2-oxo-1'-phenylspiro[1H-indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile?
You can request a quote for 6'-amino-7-bromo-3',5-dimethyl-2-oxo-1'-phenylspiro[1H-indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6'-amino-7-bromo-3',5-dimethyl-2-oxo-1'-phenylspiro[1H-indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6'-amino-7-bromo-3',5-dimethyl-2-oxo-1'-phenylspiro[1H-indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.