6'-amino-3'-ethyl-1-(3-methoxybenzyl)-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
TL;DR: 6'-amino-3'-ethyl-1-(3-methoxybenzyl)-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile (CAS 891465-24-0) is a chemical compound with molecular formula C24H21N5O3 and molecular weight 427.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-3-ethyl-1'-[(3-methoxyphenyl)methyl]-2'-oxospiro[2H-pyrano[2,3-c]pyrazole-4,3'-indole]-5-carbonitrile
Also Known As: 6'-amino-3'-ethyl-1-(3-methoxybenzyl)-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile, 6'-amino-3'-ethyl-1-(3-methoxybenzyl)-2-oxo-2'H-spiro[indoline-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile, 6-amino-3-ethyl-1'-[(3-methoxyphenyl)methyl]-2'-oxospiro[2H-pyrano[2,3-c]pyrazole-4,3'-indole]-5-carbonitrile
| Molecular Formula | C24H21N5O3 |
|---|---|
| Molecular Weight | 427.16 g/mol |
| LogP | 2.89988 |
| Topological Polar Surface Area | 117.26 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 427.16443 |
| Heavy Atoms | 32 |
| Complexity | 1319.1641 |
Chemical Identifiers
| CAS Number | 891465-24-0 |
|---|---|
| SMILES | CCC1=C2C(=NN1)OC(=C(C23C4=CC=CC=C4N(C3=O)CC5=CC(=CC=C5)OC)C#N)N |
Product Overview
6'-amino-3'-ethyl-1-(3-methoxybenzyl)-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile (CAS 891465-24-0), with molecular formula C24H21N5O3 and molecular weight 427.16 g/mol. IUPAC: 6-amino-3-ethyl-1'-[(3-methoxyphenyl)methyl]-2'-oxospiro[2H-pyrano[2,3-c]pyrazole-4,3'-indole]-5-carbonitrile.
Chemical Property Profile of 6'-amino-3'-ethyl-1-(3-methoxybenzyl)-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
Property Insights of 6'-amino-3'-ethyl-1-(3-methoxybenzyl)-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
The XLogP value of 2.89988 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6'-amino-3'-ethyl-1-(3-methoxybenzyl)-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile. The TPSA of 117.26 Ų falls within the moderate polarity range, balancing permeability and solubility for 6'-amino-3'-ethyl-1-(3-methoxybenzyl)-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile. Following Lipinski's Rule of Five, 6'-amino-3'-ethyl-1-(3-methoxybenzyl)-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile has 2 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 6'-amino-3'-ethyl-1-(3-methoxybenzyl)-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile?
The CAS number of 6'-amino-3'-ethyl-1-(3-methoxybenzyl)-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile is 891465-24-0.
What is the molecular formula of 6'-amino-3'-ethyl-1-(3-methoxybenzyl)-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile?
The molecular formula of 6'-amino-3'-ethyl-1-(3-methoxybenzyl)-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile is C24H21N5O3.
What is the molecular weight of 6'-amino-3'-ethyl-1-(3-methoxybenzyl)-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile?
The molecular weight of 6'-amino-3'-ethyl-1-(3-methoxybenzyl)-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile is 427.16 g/mol.
Where can I buy 6'-amino-3'-ethyl-1-(3-methoxybenzyl)-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile?
You can request a quote for 6'-amino-3'-ethyl-1-(3-methoxybenzyl)-2-oxo-1,2-dihydro-1'H-spiro[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-3'-ethyl-1-(3-methoxybenzyl)-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6'-amino-3'-ethyl-1-(3-methoxybenzyl)-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.