C20H23N4O3.Cl
TL;DR: C20H23N4O3.Cl (CAS 72906-18-4) is a chemical compound with molecular formula C20H23ClN4O3 and molecular weight 402.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methoxyphenyl)-N-[(1,3,3-trimethyl-5-nitroindol-1-ium-2-yl)methylideneamino]methanamine chloride
Also Known As: EINECS 276-992-6, 2-[[(4-METHOXYPHENYL)METHYLHYDRAZONO]METHYL]-1,3,3-TRIMETHYL-5-NITRO-3H-INDOLIUM CHLORIDE, 3H-Indolium, 2-(((4-methoxyphenyl)methylhydrazono)methyl)-1,3,3-trimethyl-5-nitro-, chloride, 3H-Indolium, 2-((2-(4-methoxyphenyl)-2-methylhydrazinylidene)methyl)-1,3,3-trimethyl-5-nitro-, chloride (1:1), 3H-Indolium, 2-[[(4-methoxyphenyl)methylhydrazono]methyl]-1,3,3-trimethyl-5-nitro-, chloride
| Molecular Formula | C20H23ClN4O3 |
|---|---|
| Molecular Weight | 402.15 g/mol |
| LogP | 0.389 |
| Topological Polar Surface Area | 79.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 402.14587 |
| Heavy Atoms | 28 |
| Complexity | 936.96704 |
Chemical Identifiers
| CAS Number | 72906-18-4 |
|---|---|
| SMILES | CC1(C2=C(C=CC(=C2)[N+](=O)[O-])[N+](=C1C=NNCC3=CC=C(C=C3)OC)C)C.[Cl-] |
Product Overview
C20H23N4O3.Cl (CAS 72906-18-4), with molecular formula C20H23ClN4O3 and molecular weight 402.15 g/mol. IUPAC: 1-(4-methoxyphenyl)-N-[(1,3,3-trimethyl-5-nitroindol-1-ium-2-yl)methylideneamino]methanamine chloride.
Chemical Property Profile of C20H23N4O3.Cl
Property Insights of C20H23N4O3.Cl
The XLogP value of 0.389 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C20H23N4O3.Cl. The TPSA of 79.77 Ų falls within the moderate polarity range, balancing permeability and solubility for C20H23N4O3.Cl. Following Lipinski's Rule of Five, C20H23N4O3.Cl has 1 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 C20H23N4O3.Cl?
The CAS number of C20H23N4O3.Cl is 72906-18-4.
What is the molecular formula of C20H23N4O3.Cl?
The molecular formula of C20H23N4O3.Cl is C20H23ClN4O3.
What is the molecular weight of C20H23N4O3.Cl?
The molecular weight of C20H23N4O3.Cl is 402.15 g/mol.
Where can I buy C20H23N4O3.Cl?
You can request a quote for C20H23N4O3.Cl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C20H23N4O3.Cl?
Yes, KEHONG BIO provides custom synthesis services for C20H23N4O3.Cl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.