Ethyl 8-amino-7-oxo-3,7-dihydropyrano[3,2-e]indole-2-carboxylate
TL;DR: Ethyl 8-amino-7-oxo-3,7-dihydropyrano[3,2-e]indole-2-carboxylate (CAS 858740-49-5) is a chemical compound with molecular formula C14H12N2O4 and molecular weight 272.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 8-amino-7-oxo-3H-pyrano[3,2-e]indole-2-carboxylate
Also Known As: ethyl 8-amino-7-oxo-3,7-dihydropyrano[3,2-e]indole-2-carboxylate, ethyl 8-amino-7-oxo-3H-pyrano[3,2-e]indole-2-carboxylate
| Molecular Formula | C14H12N2O4 |
|---|---|
| Molecular Weight | 272.08 g/mol |
| LogP | 2.0332 |
| Topological Polar Surface Area | 98.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 272.0797 |
| Heavy Atoms | 20 |
| Complexity | 875.88306 |
Chemical Identifiers
| CAS Number | 858740-49-5 |
|---|---|
| SMILES | CCOC(=O)C1=CC2=C(N1)C=CC3=C2C=C(C(=O)O3)N |
Product Overview
Ethyl 8-amino-7-oxo-3,7-dihydropyrano[3,2-e]indole-2-carboxylate (CAS 858740-49-5), with molecular formula C14H12N2O4 and molecular weight 272.08 g/mol. IUPAC: ethyl 8-amino-7-oxo-3H-pyrano[3,2-e]indole-2-carboxylate.
Chemical Property Profile of Ethyl 8-amino-7-oxo-3,7-dihydropyrano[3,2-e]indole-2-carboxylate
Property Insights of Ethyl 8-amino-7-oxo-3,7-dihydropyrano[3,2-e]indole-2-carboxylate
The XLogP value of 2.0332 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 8-amino-7-oxo-3,7-dihydropyrano[3,2-e]indole-2-carboxylate. The TPSA of 98.32 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 8-amino-7-oxo-3,7-dihydropyrano[3,2-e]indole-2-carboxylate. Following Lipinski's Rule of Five, Ethyl 8-amino-7-oxo-3,7-dihydropyrano[3,2-e]indole-2-carboxylate 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 Ethyl 8-amino-7-oxo-3,7-dihydropyrano[3,2-e]indole-2-carboxylate?
The CAS number of Ethyl 8-amino-7-oxo-3,7-dihydropyrano[3,2-e]indole-2-carboxylate is 858740-49-5.
What is the molecular formula of Ethyl 8-amino-7-oxo-3,7-dihydropyrano[3,2-e]indole-2-carboxylate?
The molecular formula of Ethyl 8-amino-7-oxo-3,7-dihydropyrano[3,2-e]indole-2-carboxylate is C14H12N2O4.
What is the molecular weight of Ethyl 8-amino-7-oxo-3,7-dihydropyrano[3,2-e]indole-2-carboxylate?
The molecular weight of Ethyl 8-amino-7-oxo-3,7-dihydropyrano[3,2-e]indole-2-carboxylate is 272.08 g/mol.
Where can I buy Ethyl 8-amino-7-oxo-3,7-dihydropyrano[3,2-e]indole-2-carboxylate?
You can request a quote for Ethyl 8-amino-7-oxo-3,7-dihydropyrano[3,2-e]indole-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 8-amino-7-oxo-3,7-dihydropyrano[3,2-e]indole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 8-amino-7-oxo-3,7-dihydropyrano[3,2-e]indole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.