5'-Methoxy-1',3',3'-trimethyl-8-nitrospiro[chromene-2,2'-indoline]
TL;DR: 5'-Methoxy-1',3',3'-trimethyl-8-nitrospiro[chromene-2,2'-indoline] (CAS 112656-33-4) 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.
5'-methoxy-1',3',3'-trimethyl-8-nitrospiro[chromene-2,2'-indole]
Also Known As: 5'-methoxy-1',3',3'-trimethyl-8-nitrospiro[chromene-2,2'-indole], 5'-methoxy-1',3',3'-trimethyl-8-nitrospiro[chromene-2,2'-indoline], 5'-methoxy-1',3',3'-trimethyl-8-nitro-1',3'-dihydrospiro[chromene-2,2'-indole]
| Molecular Formula | C20H20N2O4 |
|---|---|
| Molecular Weight | 352.14 g/mol |
| LogP | 4.1329 |
| Topological Polar Surface Area | 64.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 352.1423 |
| Heavy Atoms | 26 |
| Complexity | 950.8225 |
Chemical Identifiers
| CAS Number | 112656-33-4 |
|---|---|
| SMILES | CC1(C2=C(C=CC(=C2)OC)N(C13C=CC4=C(O3)C(=CC=C4)[N+](=O)[O-])C)C |
Product Overview
5'-Methoxy-1',3',3'-trimethyl-8-nitrospiro[chromene-2,2'-indoline] (CAS 112656-33-4), with molecular formula C20H20N2O4 and molecular weight 352.14 g/mol. IUPAC: 5'-methoxy-1',3',3'-trimethyl-8-nitrospiro[chromene-2,2'-indole].
Chemical Property Profile of 5'-Methoxy-1',3',3'-trimethyl-8-nitrospiro[chromene-2,2'-indoline]
Property Insights of 5'-Methoxy-1',3',3'-trimethyl-8-nitrospiro[chromene-2,2'-indoline]
The XLogP value of 4.1329 indicates that 5'-Methoxy-1',3',3'-trimethyl-8-nitrospiro[chromene-2,2'-indoline] is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.84 Ų falls within the moderate polarity range, balancing permeability and solubility for 5'-Methoxy-1',3',3'-trimethyl-8-nitrospiro[chromene-2,2'-indoline]. Following Lipinski's Rule of Five, 5'-Methoxy-1',3',3'-trimethyl-8-nitrospiro[chromene-2,2'-indoline] 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 5'-Methoxy-1',3',3'-trimethyl-8-nitrospiro[chromene-2,2'-indoline]?
The CAS number of 5'-Methoxy-1',3',3'-trimethyl-8-nitrospiro[chromene-2,2'-indoline] is 112656-33-4.
What is the molecular formula of 5'-Methoxy-1',3',3'-trimethyl-8-nitrospiro[chromene-2,2'-indoline]?
The molecular formula of 5'-Methoxy-1',3',3'-trimethyl-8-nitrospiro[chromene-2,2'-indoline] is C20H20N2O4.
What is the molecular weight of 5'-Methoxy-1',3',3'-trimethyl-8-nitrospiro[chromene-2,2'-indoline]?
The molecular weight of 5'-Methoxy-1',3',3'-trimethyl-8-nitrospiro[chromene-2,2'-indoline] is 352.14 g/mol.
Where can I buy 5'-Methoxy-1',3',3'-trimethyl-8-nitrospiro[chromene-2,2'-indoline]?
You can request a quote for 5'-Methoxy-1',3',3'-trimethyl-8-nitrospiro[chromene-2,2'-indoline] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5'-Methoxy-1',3',3'-trimethyl-8-nitrospiro[chromene-2,2'-indoline]?
Yes, KEHONG BIO provides custom synthesis services for 5'-Methoxy-1',3',3'-trimethyl-8-nitrospiro[chromene-2,2'-indoline] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.