![6'-amino-3'-butyl-5-nitro-2-oxo-1'H-spiro[indoline-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile structure](/static/products/674/674807-42-2.png)
6'-amino-3'-butyl-5-nitro-2-oxo-1'H-spiro[indoline-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
TL;DR: 6'-amino-3'-butyl-5-nitro-2-oxo-1'H-spiro[indoline-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile (CAS 674807-42-2) is a chemical compound with molecular formula C18H16N6O4 and molecular weight 380.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6'-amino-3'-butyl-5-nitro-2-oxospiro[1H-indole-3,4'-2H-pyrano[2,3-c]pyrazole]-5'-carbonitrile
Also Known As: 6'-amino-3'-butyl-5-nitro-2-oxo-1'H-spiro[indoline-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile, 6'-amino-3'-butyl-5-nitro-2-oxo-1,2-dihydro-2'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile, 6'-amino-3'-butyl-5-nitro-2-oxospiro[1H-indole-3,4'-2H-pyrano[2,3-c]pyrazole]-5'-carbonitrile, 6-amino-3-butyl-14-nitro-11-oxospiro[4H-pyrano[3,2-d]pyrazole-4,3'-indoline]-5 -carbonitrile
| Molecular Formula | C18H16N6O4 |
|---|---|
| Molecular Weight | 380.12 g/mol |
| LogP | 1.98498 |
| Topological Polar Surface Area | 159.96 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 380.1233 |
| Heavy Atoms | 28 |
| Complexity | 1095.9808 |
Chemical Identifiers
| CAS Number | 674807-42-2 |
|---|---|
| SMILES | CCCCC1=C2C(=NN1)OC(=C(C23C4=C(C=CC(=C4)[N+](=O)[O-])NC3=O)C#N)N |
Product Overview
6'-amino-3'-butyl-5-nitro-2-oxo-1'H-spiro[indoline-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile (CAS 674807-42-2), with molecular formula C18H16N6O4 and molecular weight 380.12 g/mol. IUPAC: 6'-amino-3'-butyl-5-nitro-2-oxospiro[1H-indole-3,4'-2H-pyrano[2,3-c]pyrazole]-5'-carbonitrile.
Chemical Property Profile of 6'-amino-3'-butyl-5-nitro-2-oxo-1'H-spiro[indoline-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
Property Insights of 6'-amino-3'-butyl-5-nitro-2-oxo-1'H-spiro[indoline-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
The XLogP value of 1.98498 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6'-amino-3'-butyl-5-nitro-2-oxo-1'H-spiro[indoline-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile. The TPSA of 159.96 Ų indicates high polarity, suggesting 6'-amino-3'-butyl-5-nitro-2-oxo-1'H-spiro[indoline-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 6'-amino-3'-butyl-5-nitro-2-oxo-1'H-spiro[indoline-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile has 3 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 6'-amino-3'-butyl-5-nitro-2-oxo-1'H-spiro[indoline-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile?
The CAS number of 6'-amino-3'-butyl-5-nitro-2-oxo-1'H-spiro[indoline-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile is 674807-42-2.
What is the molecular formula of 6'-amino-3'-butyl-5-nitro-2-oxo-1'H-spiro[indoline-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile?
The molecular formula of 6'-amino-3'-butyl-5-nitro-2-oxo-1'H-spiro[indoline-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile is C18H16N6O4.
What is the molecular weight of 6'-amino-3'-butyl-5-nitro-2-oxo-1'H-spiro[indoline-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile?
The molecular weight of 6'-amino-3'-butyl-5-nitro-2-oxo-1'H-spiro[indoline-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile is 380.12 g/mol.
Where can I buy 6'-amino-3'-butyl-5-nitro-2-oxo-1'H-spiro[indoline-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile?
You can request a quote for 6'-amino-3'-butyl-5-nitro-2-oxo-1'H-spiro[indoline-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'-butyl-5-nitro-2-oxo-1'H-spiro[indoline-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6'-amino-3'-butyl-5-nitro-2-oxo-1'H-spiro[indoline-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.