同甲氨氯
TL;DR: 同甲氨氯 (CAS 34301-55-8) is a chemical compound with molecular formula C28H26ClN7 and molecular weight 495.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
同甲氨氯
3-[2-(3-amino-5-ethyl-6-phenylphenanthridin-5-ium-8-yl)iminohydrazinyl]benzenecarboximidamide chloride
Also Known As: Isometamidium chloride, Samorin, chloride, Trypamidium, Isometamidium
| Molecular Formula | C28H26ClN7 |
|---|---|
| Molecular Weight | 495.19 g/mol |
| LogP | 2.95 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 495.19382 |
| Heavy Atoms | 36 |
| Complexity | 735.0 |
Chemical Identifiers
| CAS Number | 34301-55-8 |
|---|---|
| SMILES | CC[N+]1=C2C=C(C=CC2=C3C=CC(=CC3=C1C4=CC=CC=C4)N=NNC5=CC=CC(=C5)C(=N)N)N.[Cl-] |
| InChIKey | QNZJTSGALAVCLH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
同甲氨氯 (CAS 34301-55-8), with molecular formula C28H26ClN7 and molecular weight 495.19 g/mol. IUPAC: 3-[2-(3-amino-5-ethyl-6-phenylphenanthridin-5-ium-8-yl)iminohydrazinyl]benzenecarboximidamide chloride.
Chemical Property Profile of 同甲氨氯
Property Insights of 同甲氨氯
The XLogP value of 2.95 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 同甲氨氯. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 同甲氨氯. Following Lipinski's Rule of Five, 同甲氨氯 has 4 hydrogen bond donor(s) and 6 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 同甲氨氯?
The CAS number of 同甲氨氯 is 34301-55-8.
What is the molecular formula of 同甲氨氯?
The molecular formula of 同甲氨氯 is C28H26ClN7.
What is the molecular weight of 同甲氨氯?
The molecular weight of 同甲氨氯 is 495.19 g/mol.
Where can I buy 同甲氨氯?
You can request a quote for 同甲氨氯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 同甲氨氯?
Yes, KEHONG BIO provides custom synthesis services for 同甲氨氯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.