乙啶氯化物
TL;DR: 乙啶氯化物 (CAS 602-52-8) is a chemical compound with molecular formula C21H20ClN3 and molecular weight 349.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
乙啶氯化物
5-ethyl-6-phenylphenanthridin-5-ium-3,8-diamine chloride
Also Known As: Ethidium chloride, HOMIDIUM CHLORIDE, Novidium chloride, Babidium chloride, Ethidium chloride (ET)
| Molecular Formula | C21H20ClN3 |
|---|---|
| Molecular Weight | 349.13 g/mol |
| LogP | 1.14 |
| Topological Polar Surface Area | 55.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 349.13458 |
| Heavy Atoms | 25 |
| Complexity | 419.0 |
Chemical Identifiers
| CAS Number | 602-52-8 |
|---|---|
| SMILES | CC[N+]1=C2C=C(C=CC2=C3C=CC(=CC3=C1C4=CC=CC=C4)N)N.[Cl-] |
| InChIKey | BITVSRNAFFZUFW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
乙啶氯化物 (CAS 602-52-8), with molecular formula C21H20ClN3 and molecular weight 349.13 g/mol. IUPAC: 5-ethyl-6-phenylphenanthridin-5-ium-3,8-diamine chloride.
Chemical Property Profile of 乙啶氯化物
Property Insights of 乙啶氯化物
The XLogP value of 1.14 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 乙啶氯化物. With a topological polar surface area (TPSA) of 55.9 Ų, 乙啶氯化物 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 乙啶氯化物 has 2 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 乙啶氯化物?
The CAS number of 乙啶氯化物 is 602-52-8.
What is the molecular formula of 乙啶氯化物?
The molecular formula of 乙啶氯化物 is C21H20ClN3.
What is the molecular weight of 乙啶氯化物?
The molecular weight of 乙啶氯化物 is 349.13 g/mol.
Where can I buy 乙啶氯化物?
You can request a quote for 乙啶氯化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 乙啶氯化物?
Yes, KEHONG BIO provides custom synthesis services for 乙啶氯化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.