ChemDiv1_018260
TL;DR: ChemDiv1_018260 (CAS 421586-98-3) is a chemical compound with molecular formula C23H15N3O6 and molecular weight 429.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(2'-amino-3'-cyano-2,5'-dioxospiro[indole-3,4'-pyrano[3,2-c]chromene]-1-yl)acetate
Also Known As: ChemDiv1_018260, A2657/0113276, methyl (2'-amino-3'-cyano-2,5'-dioxo-5'H-spiro[indole-3,4'-pyrano[3,2-c]chromen]-1(2H)-yl)acetate, methyl 2-(2'-amino-3'-cyano-2,5'-dioxo-5'H-spiro[indoline-3,4'-pyrano[3,2-c]chromen]-1-yl)acetate, methyl 2-(2'-amino-3'-cyano-2,5'-dioxospiro[indole-3,4'-pyrano[3,2-c]chromene]-1-yl)acetate
| Molecular Formula | C23H15N3O6 |
|---|---|
| Molecular Weight | 429.10 g/mol |
| LogP | 1.68498 |
| Topological Polar Surface Area | 135.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 429.0961 |
| Heavy Atoms | 32 |
| Complexity | 1464.5685 |
Chemical Identifiers
| CAS Number | 421586-98-3 |
|---|---|
| SMILES | COC(=O)CN1C2=CC=CC=C2C3(C1=O)C(=C(OC4=C3C(=O)OC5=CC=CC=C54)N)C#N |
Product Overview
ChemDiv1_018260 (CAS 421586-98-3), with molecular formula C23H15N3O6 and molecular weight 429.10 g/mol. IUPAC: methyl 2-(2'-amino-3'-cyano-2,5'-dioxospiro[indole-3,4'-pyrano[3,2-c]chromene]-1-yl)acetate.
Chemical Property Profile of ChemDiv1_018260
Property Insights of ChemDiv1_018260
The XLogP value of 1.68498 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_018260. The TPSA of 135.86 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_018260. Following Lipinski's Rule of Five, ChemDiv1_018260 has 1 hydrogen bond donor(s) and 8 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_018260?
The CAS number of ChemDiv1_018260 is 421586-98-3.
What is the molecular formula of ChemDiv1_018260?
The molecular formula of ChemDiv1_018260 is C23H15N3O6.
What is the molecular weight of ChemDiv1_018260?
The molecular weight of ChemDiv1_018260 is 429.10 g/mol.
Where can I buy ChemDiv1_018260?
You can request a quote for ChemDiv1_018260 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_018260?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_018260 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.