Brevicolline, hydrochloride
TL;DR: Brevicolline, hydrochloride (CAS 34443-87-3) is a chemical compound with molecular formula C17H20ClN3 and molecular weight 301.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-4-[(2S)-1-methylpyrrolidin-2-yl]-9H-pyrido[3,4-b]indole;hydrochloride
Also Known As: Brevicolline, hydrochloride, 9H-Pyrido(3,4-b)indole, 1-methyl-4-(1-methyl-2-pyrrolidinyl)-, hydrochloride, (S)-, 1-methyl-4-[(2S)-1-methylpyrrolidin-2-yl]-9H-pyrido[3,4-b]indole hydrochloride, 1-Methyl-4-[(2S)-1-methylpyrrolidin-2-yl]-9H-pyrido[3,4-b]indole--hydrogen chloride (1/1), RefChem:330203
| Molecular Formula | C17H20ClN3 |
|---|---|
| Molecular Weight | 301.13 g/mol |
| LogP | 4.21302 |
| Topological Polar Surface Area | 31.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 301.13458 |
| Heavy Atoms | 21 |
| Complexity | 793.1805 |
Chemical Identifiers
| CAS Number | 34443-87-3 |
|---|---|
| SMILES | CC1=NC=C(C2=C1NC3=CC=CC=C32)[C@@H]4CCCN4C.Cl |
Product Overview
Brevicolline, hydrochloride (CAS 34443-87-3), with molecular formula C17H20ClN3 and molecular weight 301.13 g/mol. IUPAC: 1-methyl-4-[(2S)-1-methylpyrrolidin-2-yl]-9H-pyrido[3,4-b]indole;hydrochloride.
Chemical Property Profile of Brevicolline, hydrochloride
Property Insights of Brevicolline, hydrochloride
The XLogP value of 4.21302 indicates that Brevicolline, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 31.92 Ų, Brevicolline, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Brevicolline, hydrochloride has 1 hydrogen bond donor(s) and 2 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 Brevicolline, hydrochloride?
The CAS number of Brevicolline, hydrochloride is 34443-87-3.
What is the molecular formula of Brevicolline, hydrochloride?
The molecular formula of Brevicolline, hydrochloride is C17H20ClN3.
What is the molecular weight of Brevicolline, hydrochloride?
The molecular weight of Brevicolline, hydrochloride is 301.13 g/mol.
Where can I buy Brevicolline, hydrochloride?
You can request a quote for Brevicolline, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Brevicolline, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Brevicolline, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.