4-[Benzyl(2-hydroxyethyl)amino]-1,2-naphthalenedione
TL;DR: 4-[Benzyl(2-hydroxyethyl)amino]-1,2-naphthalenedione (CAS 337471-24-6) is a chemical compound with molecular formula C19H17NO3 and molecular weight 307.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[benzyl(2-hydroxyethyl)amino]naphthalene-1,2-dione
Also Known As: BAS 00546669, 4-[benzyl(2-hydroxyethyl)amino]-1,2-naphthalenedione, 4-[benzyl(2-hydroxyethyl)amino]naphthalene-1,2-dione, 4-[Benzyl-(2-hydroxy-ethyl)-amino]-[1,2]naphthoquinone
| Molecular Formula | C19H17NO3 |
|---|---|
| Molecular Weight | 307.12 g/mol |
| LogP | 2.2874 |
| Topological Polar Surface Area | 57.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 307.12085 |
| Heavy Atoms | 23 |
| Complexity | 765.19403 |
Chemical Identifiers
| CAS Number | 337471-24-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN(CCO)C2=CC(=O)C(=O)C3=CC=CC=C32 |
Product Overview
4-[Benzyl(2-hydroxyethyl)amino]-1,2-naphthalenedione (CAS 337471-24-6), with molecular formula C19H17NO3 and molecular weight 307.12 g/mol. IUPAC: 4-[benzyl(2-hydroxyethyl)amino]naphthalene-1,2-dione.
Chemical Property Profile of 4-[Benzyl(2-hydroxyethyl)amino]-1,2-naphthalenedione
Property Insights of 4-[Benzyl(2-hydroxyethyl)amino]-1,2-naphthalenedione
The XLogP value of 2.2874 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[Benzyl(2-hydroxyethyl)amino]-1,2-naphthalenedione. With a topological polar surface area (TPSA) of 57.61 Ų, 4-[Benzyl(2-hydroxyethyl)amino]-1,2-naphthalenedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[Benzyl(2-hydroxyethyl)amino]-1,2-naphthalenedione 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 4-[Benzyl(2-hydroxyethyl)amino]-1,2-naphthalenedione?
The CAS number of 4-[Benzyl(2-hydroxyethyl)amino]-1,2-naphthalenedione is 337471-24-6.
What is the molecular formula of 4-[Benzyl(2-hydroxyethyl)amino]-1,2-naphthalenedione?
The molecular formula of 4-[Benzyl(2-hydroxyethyl)amino]-1,2-naphthalenedione is C19H17NO3.
What is the molecular weight of 4-[Benzyl(2-hydroxyethyl)amino]-1,2-naphthalenedione?
The molecular weight of 4-[Benzyl(2-hydroxyethyl)amino]-1,2-naphthalenedione is 307.12 g/mol.
Where can I buy 4-[Benzyl(2-hydroxyethyl)amino]-1,2-naphthalenedione?
You can request a quote for 4-[Benzyl(2-hydroxyethyl)amino]-1,2-naphthalenedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[Benzyl(2-hydroxyethyl)amino]-1,2-naphthalenedione?
Yes, KEHONG BIO provides custom synthesis services for 4-[Benzyl(2-hydroxyethyl)amino]-1,2-naphthalenedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.