![1,4-Naphthalenedione, 2-chloro-3-[(4-methoxyphenyl)amino]- structure](/static/products/2235/22359-32-6.webp)
1,4-Naphthalenedione, 2-chloro-3-[(4-methoxyphenyl)amino]-
TL;DR: 1,4-Naphthalenedione, 2-chloro-3-[(4-methoxyphenyl)amino]- (CAS 22359-32-6) is a chemical compound with molecular formula C17H12ClNO3 and molecular weight 313.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-3-(4-methoxyanilino)naphthalene-1,4-dione
Also Known As: 2-chloro-3-(4-methoxyanilino)naphthalene-1,4-dione, 2-chloro-3-[(4-methoxyphenyl)amino]naphthalene-1,4-dione, 2-chloro-3-(4-methoxyanilino)naphthoquinone, 3-
| Molecular Formula | C17H12ClNO3 |
|---|---|
| Molecular Weight | 313.05 g/mol |
| LogP | 3.6367 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 313.05057 |
| Heavy Atoms | 22 |
| Complexity | 793.8063 |
Chemical Identifiers
| CAS Number | 22359-32-6 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC2=C(C(=O)C3=CC=CC=C3C2=O)Cl |
Product Overview
1,4-Naphthalenedione, 2-chloro-3-[(4-methoxyphenyl)amino]- (CAS 22359-32-6), with molecular formula C17H12ClNO3 and molecular weight 313.05 g/mol. IUPAC: 2-chloro-3-(4-methoxyanilino)naphthalene-1,4-dione.
Chemical Property Profile of 1,4-Naphthalenedione, 2-chloro-3-[(4-methoxyphenyl)amino]-
Property Insights of 1,4-Naphthalenedione, 2-chloro-3-[(4-methoxyphenyl)amino]-
The XLogP value of 3.6367 indicates that 1,4-Naphthalenedione, 2-chloro-3-[(4-methoxyphenyl)amino]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, 1,4-Naphthalenedione, 2-chloro-3-[(4-methoxyphenyl)amino]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Naphthalenedione, 2-chloro-3-[(4-methoxyphenyl)amino]- has 1 hydrogen bond donor(s) and 4 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 1,4-Naphthalenedione, 2-chloro-3-[(4-methoxyphenyl)amino]-?
The CAS number of 1,4-Naphthalenedione, 2-chloro-3-[(4-methoxyphenyl)amino]- is 22359-32-6.
What is the molecular formula of 1,4-Naphthalenedione, 2-chloro-3-[(4-methoxyphenyl)amino]-?
The molecular formula of 1,4-Naphthalenedione, 2-chloro-3-[(4-methoxyphenyl)amino]- is C17H12ClNO3.
What is the molecular weight of 1,4-Naphthalenedione, 2-chloro-3-[(4-methoxyphenyl)amino]-?
The molecular weight of 1,4-Naphthalenedione, 2-chloro-3-[(4-methoxyphenyl)amino]- is 313.05 g/mol.
Where can I buy 1,4-Naphthalenedione, 2-chloro-3-[(4-methoxyphenyl)amino]-?
You can request a quote for 1,4-Naphthalenedione, 2-chloro-3-[(4-methoxyphenyl)amino]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Naphthalenedione, 2-chloro-3-[(4-methoxyphenyl)amino]-?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Naphthalenedione, 2-chloro-3-[(4-methoxyphenyl)amino]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.