ChemDiv1_002314
TL;DR: ChemDiv1_002314 (CAS 5192-73-4) is a chemical compound with molecular formula C17H15N3O4 and molecular weight 325.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6'-amino-5'-cyano-2'-methyl-2-oxospiro[1H-indole-3,4'-pyran]-3'-carboxylate
Also Known As: ChemDiv1_002314, BAS 01280222, J2.813.578E, ethyl 6'-amino-5'-cyano-2'-methyl-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carboxylate, A0534/0024619
| Molecular Formula | C17H15N3O4 |
|---|---|
| Molecular Weight | 325.11 g/mol |
| LogP | 1.43768 |
| Topological Polar Surface Area | 114.44 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 325.10626 |
| Heavy Atoms | 24 |
| Complexity | 862.8318 |
Chemical Identifiers
| CAS Number | 5192-73-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(OC(=C(C12C3=CC=CC=C3NC2=O)C#N)N)C |
Product Overview
ChemDiv1_002314 (CAS 5192-73-4), with molecular formula C17H15N3O4 and molecular weight 325.11 g/mol. IUPAC: ethyl 6'-amino-5'-cyano-2'-methyl-2-oxospiro[1H-indole-3,4'-pyran]-3'-carboxylate.
Chemical Property Profile of ChemDiv1_002314
Property Insights of ChemDiv1_002314
The XLogP value of 1.43768 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_002314. The TPSA of 114.44 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_002314. Following Lipinski's Rule of Five, ChemDiv1_002314 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 ChemDiv1_002314?
The CAS number of ChemDiv1_002314 is 5192-73-4.
What is the molecular formula of ChemDiv1_002314?
The molecular formula of ChemDiv1_002314 is C17H15N3O4.
What is the molecular weight of ChemDiv1_002314?
The molecular weight of ChemDiv1_002314 is 325.11 g/mol.
Where can I buy ChemDiv1_002314?
You can request a quote for ChemDiv1_002314 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_002314?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_002314 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.