![6'-amino-2-oxo-3'-[(phenylthio)methyl]-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile structure](/static/products/674/674807-30-8.png)
6'-amino-2-oxo-3'-[(phenylthio)methyl]-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
TL;DR: 6'-amino-2-oxo-3'-[(phenylthio)methyl]-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile (CAS 674807-30-8) is a chemical compound with molecular formula C21H15N5O2S and molecular weight 401.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6'-amino-2-oxo-3'-(phenylsulfanylmethyl)spiro[1H-indole-3,4'-2H-pyrano[2,3-c]pyrazole]-5'-carbonitrile
Also Known As: 6'-amino-2-oxo-3'-[(phenylthio)methyl]-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile, 6'-amino-2-oxo-3'-((phenylthio)methyl)-1'H-spiro[indoline-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile, 6'-amino-2-oxo-3'-(phenylsulfanylmethyl)spiro[1H-indole-3,4'-2H-pyrano[2,3-c]pyrazole]-5'-carbonitrile, 6'-amino-2-oxo-3'-[(phenylsulfanyl)methyl]-1,2-dihydro-2'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
| Molecular Formula | C21H15N5O2S |
|---|---|
| Molecular Weight | 401.09 g/mol |
| LogP | 3.02648 |
| Topological Polar Surface Area | 116.82 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 401.09464 |
| Heavy Atoms | 29 |
| Complexity | 1211.3094 |
Chemical Identifiers
| CAS Number | 674807-30-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)SCC2=C3C(=NN2)OC(=C(C34C5=CC=CC=C5NC4=O)C#N)N |
Product Overview
6'-amino-2-oxo-3'-[(phenylthio)methyl]-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile (CAS 674807-30-8), with molecular formula C21H15N5O2S and molecular weight 401.09 g/mol. IUPAC: 6'-amino-2-oxo-3'-(phenylsulfanylmethyl)spiro[1H-indole-3,4'-2H-pyrano[2,3-c]pyrazole]-5'-carbonitrile.
Chemical Property Profile of 6'-amino-2-oxo-3'-[(phenylthio)methyl]-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
Property Insights of 6'-amino-2-oxo-3'-[(phenylthio)methyl]-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
The XLogP value of 3.02648 indicates that 6'-amino-2-oxo-3'-[(phenylthio)methyl]-1,2-dihydro-1'H-spiro[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 116.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 6'-amino-2-oxo-3'-[(phenylthio)methyl]-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile. Following Lipinski's Rule of Five, 6'-amino-2-oxo-3'-[(phenylthio)methyl]-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile has 3 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-2-oxo-3'-[(phenylthio)methyl]-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile?
The CAS number of 6'-amino-2-oxo-3'-[(phenylthio)methyl]-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile is 674807-30-8.
What is the molecular formula of 6'-amino-2-oxo-3'-[(phenylthio)methyl]-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile?
The molecular formula of 6'-amino-2-oxo-3'-[(phenylthio)methyl]-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile is C21H15N5O2S.
What is the molecular weight of 6'-amino-2-oxo-3'-[(phenylthio)methyl]-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile?
The molecular weight of 6'-amino-2-oxo-3'-[(phenylthio)methyl]-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile is 401.09 g/mol.
Where can I buy 6'-amino-2-oxo-3'-[(phenylthio)methyl]-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile?
You can request a quote for 6'-amino-2-oxo-3'-[(phenylthio)methyl]-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-2-oxo-3'-[(phenylthio)methyl]-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-2-oxo-3'-[(phenylthio)methyl]-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.