5-Methyl-2-(1H-tetraazol-5-yl)pyrano(3,2-b)indol-4(5H)-one
TL;DR: 5-Methyl-2-(1H-tetraazol-5-yl)pyrano(3,2-b)indol-4(5H)-one (CAS 70458-61-6) is a chemical compound with molecular formula C13H9N5O2 and molecular weight 267.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-2-(2H-tetrazol-5-yl)pyrano[3,2-b]indol-4-one
Also Known As: 5-Methyl-2-(1H-tetraazol-5-yl)pyrano(3,2-b)indol-4(5H)-one, 5-methyl-2-(2H-tetrazol-5-yl)pyrano[3,2-b]indol-4-one, 5-Methyl-2-(1H-tetraazol-5-yl)pyrano[3,2-b]indol-4(5H)-one, 5-methyl-2-(1H-tetrazol-5-yl)pyrano[3,2-b]indol-4-one, 5-METHYL-2-(2H-TETRAZOL-5-YL)PYRANO(3,2-B)INDOL-4(5H)-ONE
| Molecular Formula | C13H9N5O2 |
|---|---|
| Molecular Weight | 267.08 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 85.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 267.07562 |
| Heavy Atoms | 20 |
| Complexity | 454.0 |
Chemical Identifiers
| CAS Number | 70458-61-6 |
|---|---|
| SMILES | CN1C2=CC=CC=C2C3=C1C(=O)C=C(O3)C4=NNN=N4 |
| InChIKey | NPXNAEKNDFKQAM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Methyl-2-(1H-tetraazol-5-yl)pyrano(3,2-b)indol-4(5H)-one (CAS 70458-61-6), with molecular formula C13H9N5O2 and molecular weight 267.08 g/mol. IUPAC: 5-methyl-2-(2H-tetrazol-5-yl)pyrano[3,2-b]indol-4-one.
Chemical Property Profile of 5-Methyl-2-(1H-tetraazol-5-yl)pyrano(3,2-b)indol-4(5H)-one
Property Insights of 5-Methyl-2-(1H-tetraazol-5-yl)pyrano(3,2-b)indol-4(5H)-one
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Methyl-2-(1H-tetraazol-5-yl)pyrano(3,2-b)indol-4(5H)-one. The TPSA of 85.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Methyl-2-(1H-tetraazol-5-yl)pyrano(3,2-b)indol-4(5H)-one. Following Lipinski's Rule of Five, 5-Methyl-2-(1H-tetraazol-5-yl)pyrano(3,2-b)indol-4(5H)-one has 1 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 5-Methyl-2-(1H-tetraazol-5-yl)pyrano(3,2-b)indol-4(5H)-one?
The CAS number of 5-Methyl-2-(1H-tetraazol-5-yl)pyrano(3,2-b)indol-4(5H)-one is 70458-61-6.
What is the molecular formula of 5-Methyl-2-(1H-tetraazol-5-yl)pyrano(3,2-b)indol-4(5H)-one?
The molecular formula of 5-Methyl-2-(1H-tetraazol-5-yl)pyrano(3,2-b)indol-4(5H)-one is C13H9N5O2.
What is the molecular weight of 5-Methyl-2-(1H-tetraazol-5-yl)pyrano(3,2-b)indol-4(5H)-one?
The molecular weight of 5-Methyl-2-(1H-tetraazol-5-yl)pyrano(3,2-b)indol-4(5H)-one is 267.08 g/mol.
Where can I buy 5-Methyl-2-(1H-tetraazol-5-yl)pyrano(3,2-b)indol-4(5H)-one?
You can request a quote for 5-Methyl-2-(1H-tetraazol-5-yl)pyrano(3,2-b)indol-4(5H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methyl-2-(1H-tetraazol-5-yl)pyrano(3,2-b)indol-4(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for 5-Methyl-2-(1H-tetraazol-5-yl)pyrano(3,2-b)indol-4(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.