Demb
TL;DR: Demb (CAS 54546-19-9) is a chemical compound with molecular formula C16H18BrN3 and molecular weight 331.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-ethyl-5-methylphenanthridin-5-ium-3,8-diamine bromide
Also Known As: DEMB, RD 2610, 3,8-Diamino-6-ethyl-5-methylphenanthridinium bromide, Phenanthridinium, 3,8-diamino-6-ethyl-5-methyl-, bromide, 6-ethyl-5-methylphenanthridin-5-ium-3,8-diamine;bromide
| Molecular Formula | C16H18BrN3 |
|---|---|
| Molecular Weight | 331.07 g/mol |
| LogP | -0.4517 |
| Topological Polar Surface Area | 55.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 331.06842 |
| Heavy Atoms | 20 |
| Complexity | 319.0 |
Chemical Identifiers
| CAS Number | 54546-19-9 |
|---|---|
| SMILES | CCC1=C2C=C(C=CC2=C3C=CC(=CC3=[N+]1C)N)N.[Br-] |
| InChIKey | YVNRSOMGUGTRMU-UHFFFAOYSA-N |
Product Overview
Demb (CAS 54546-19-9), with molecular formula C16H18BrN3 and molecular weight 331.07 g/mol. IUPAC: 6-ethyl-5-methylphenanthridin-5-ium-3,8-diamine bromide.
Chemical Property Profile of Demb
Property Insights of Demb
The XLogP value of -0.4517 indicates that Demb is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 55.9 Ų, Demb exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Demb 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 Demb?
The CAS number of Demb is 54546-19-9.
What is the molecular formula of Demb?
The molecular formula of Demb is C16H18BrN3.
What is the molecular weight of Demb?
The molecular weight of Demb is 331.07 g/mol.
Where can I buy Demb?
You can request a quote for Demb directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Demb?
Yes, KEHONG BIO provides custom synthesis services for Demb and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.