![1,4-Naphthalenedione, 2-chloro-3-[(ethylphenylamino)methyl]- structure](/static/products/3817/38171-86-7.webp)
1,4-Naphthalenedione, 2-chloro-3-[(ethylphenylamino)methyl]-
TL;DR: 1,4-Naphthalenedione, 2-chloro-3-[(ethylphenylamino)methyl]- (CAS 38171-86-7) is a chemical compound with molecular formula C19H16ClNO2 and molecular weight 325.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-3-[(N-ethylanilino)methyl]naphthalene-1,4-dione
Also Known As: 1,4-Naphthalenedione, 2-chloro-3-[(ethylphenylamino)methyl]-, 2-chloro-3-[(N-ethylanilino)methyl]naphthalene-1,4-dione, 1,4-Naphthalenedione,2-chloro-3-[(ethylphenylamino)methyl], 3-chloro-2-[(ethyl-phenyl-amino)methyl]naphthalene-1,4-dione, 2-CHLORO-3-{[ETHYL(PHENYL)AMINO]METHYL}NAPHTHALENE-1,4-DIONE
| Molecular Formula | C19H16ClNO2 |
|---|---|
| Molecular Weight | 325.09 g/mol |
| LogP | 4.085 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 325.08694 |
| Heavy Atoms | 23 |
| Complexity | 796.02673 |
Chemical Identifiers
| CAS Number | 38171-86-7 |
|---|---|
| SMILES | CCN(CC1=C(C(=O)C2=CC=CC=C2C1=O)Cl)C3=CC=CC=C3 |
Product Overview
1,4-Naphthalenedione, 2-chloro-3-[(ethylphenylamino)methyl]- (CAS 38171-86-7), with molecular formula C19H16ClNO2 and molecular weight 325.09 g/mol. IUPAC: 2-chloro-3-[(N-ethylanilino)methyl]naphthalene-1,4-dione.
Chemical Property Profile of 1,4-Naphthalenedione, 2-chloro-3-[(ethylphenylamino)methyl]-
Property Insights of 1,4-Naphthalenedione, 2-chloro-3-[(ethylphenylamino)methyl]-
The XLogP value of 4.085 indicates that 1,4-Naphthalenedione, 2-chloro-3-[(ethylphenylamino)methyl]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.38 Ų, 1,4-Naphthalenedione, 2-chloro-3-[(ethylphenylamino)methyl]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Naphthalenedione, 2-chloro-3-[(ethylphenylamino)methyl]- has 0 hydrogen bond donor(s) and 3 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-[(ethylphenylamino)methyl]-?
The CAS number of 1,4-Naphthalenedione, 2-chloro-3-[(ethylphenylamino)methyl]- is 38171-86-7.
What is the molecular formula of 1,4-Naphthalenedione, 2-chloro-3-[(ethylphenylamino)methyl]-?
The molecular formula of 1,4-Naphthalenedione, 2-chloro-3-[(ethylphenylamino)methyl]- is C19H16ClNO2.
What is the molecular weight of 1,4-Naphthalenedione, 2-chloro-3-[(ethylphenylamino)methyl]-?
The molecular weight of 1,4-Naphthalenedione, 2-chloro-3-[(ethylphenylamino)methyl]- is 325.09 g/mol.
Where can I buy 1,4-Naphthalenedione, 2-chloro-3-[(ethylphenylamino)methyl]-?
You can request a quote for 1,4-Naphthalenedione, 2-chloro-3-[(ethylphenylamino)methyl]- 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-[(ethylphenylamino)methyl]-?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Naphthalenedione, 2-chloro-3-[(ethylphenylamino)methyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.