RefChem:70650
TL;DR: RefChem:70650 (CAS 1498-89-1) is a chemical compound with molecular formula C20H20N2O4 and molecular weight 352.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-methoxy-1',3',3'-trimethyl-6-nitrospiro[chromene-2,2'-indole]
Also Known As: benzopyran-2,2'-[2H]indole], 8-Methoxy-1',3',3'-trimethyl-6-nitrospiro[chromene-2,2'-indoline], Spiro[2H-1-benzopyran-2,2'-indoline], 8-methoxy-1',3',3'-trimethyl-6-nitro-, Spiro[2H-1-benzopyran-2,2'-[2H]indole],1',3'-dihydro-8-methoxy-1',3',3'-trimethyl-6-nitro-, 8-methoxy-1',3',3'-trimethyl-6-nitrospiro[chromene-2,2'-indole]
| Molecular Formula | C20H20N2O4 |
|---|---|
| Molecular Weight | 352.14 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 67.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 352.1423 |
| Heavy Atoms | 26 |
| Complexity | 601.0 |
Chemical Identifiers
| CAS Number | 1498-89-1 |
|---|---|
| SMILES | CC1(C2=CC=CC=C2N(C13C=CC4=C(O3)C(=CC(=C4)[N+](=O)[O-])OC)C)C |
| InChIKey | IZDVWQPIYXTGIF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
RefChem:70650 (CAS 1498-89-1), with molecular formula C20H20N2O4 and molecular weight 352.14 g/mol. IUPAC: 8-methoxy-1',3',3'-trimethyl-6-nitrospiro[chromene-2,2'-indole].
Chemical Property Profile of RefChem:70650
Property Insights of RefChem:70650
The XLogP value of 4.7 indicates that RefChem:70650 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.5 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:70650. Following Lipinski's Rule of Five, RefChem:70650 has 0 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 RefChem:70650?
The CAS number of RefChem:70650 is 1498-89-1.
What is the molecular formula of RefChem:70650?
The molecular formula of RefChem:70650 is C20H20N2O4.
What is the molecular weight of RefChem:70650?
The molecular weight of RefChem:70650 is 352.14 g/mol.
Where can I buy RefChem:70650?
You can request a quote for RefChem:70650 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:70650?
Yes, KEHONG BIO provides custom synthesis services for RefChem:70650 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.