龙虾肌碱
TL;DR: 龙虾肌碱 (CAS 445-30-7) is a chemical compound with molecular formula C7H7NO2 and molecular weight 137.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
龙虾肌碱
1-methylpyridin-1-ium-2-carboxylate
Also Known As: Homarine, Homarine-d3, 1-methylpyridin-1-ium-2-carboxylate, Betaine homarine, n-methylpicolinic acid
| Molecular Formula | C7H7NO2 |
|---|---|
| Molecular Weight | 137.05 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 44.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 137.04768 |
| Heavy Atoms | 10 |
| Complexity | 130.0 |
Chemical Identifiers
| CAS Number | 445-30-7 |
|---|---|
| SMILES | C[N+]1=CC=CC=C1C(=O)[O-] |
| InChIKey | BRTLKRNVNFIOPJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
龙虾肌碱 (CAS 445-30-7), with molecular formula C7H7NO2 and molecular weight 137.05 g/mol. IUPAC: 1-methylpyridin-1-ium-2-carboxylate.
Chemical Property Profile of 龙虾肌碱
Property Insights of 龙虾肌碱
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 龙虾肌碱. With a topological polar surface area (TPSA) of 44.0 Ų, 龙虾肌碱 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Homarine has 0 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 Homarine?
The CAS number of Homarine is 445-30-7.
What is the molecular formula of Homarine?
The molecular formula of Homarine is C7H7NO2.
What is the molecular weight of Homarine?
The molecular weight of Homarine is 137.05 g/mol.
Where can I buy Homarine?
You can request a quote for Homarine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Homarine?
Yes, KEHONG BIO provides custom synthesis services for Homarine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.