欧乌头碱
TL;DR: 欧乌头碱 (CAS 5008-52-6) is a chemical compound with molecular formula C19H29NO2 and molecular weight 303.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
欧乌头碱
benzoic acid;N-cyclohexylcyclohexanamine
Also Known As: Dicyclohexylamine benzoate, Dicyclohexylammonium benzoate, Benzoic acid dicyclohexylamine salt, Dicyclohexylamine-benzoate, benzoic acid,N-cyclohexylcyclohexanamine
| Molecular Formula | C19H29NO2 |
|---|---|
| Molecular Weight | 303.22 g/mol |
| LogP | 4.6262 |
| Topological Polar Surface Area | 49.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 303.21982 |
| Heavy Atoms | 22 |
| Complexity | 220.0 |
Chemical Identifiers
| CAS Number | 5008-52-6 |
|---|---|
| SMILES | C1CCC(CC1)NC2CCCCC2.C1=CC=C(C=C1)C(=O)O |
| InChIKey | QNNPHOLOYSXYNU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
欧乌头碱 (CAS 5008-52-6), with molecular formula C19H29NO2 and molecular weight 303.22 g/mol. IUPAC: benzoic acid;N-cyclohexylcyclohexanamine.
Chemical Property Profile of 欧乌头碱
Property Insights of 欧乌头碱
The XLogP value of 4.6262 indicates that 欧乌头碱 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.3 Ų, 欧乌头碱 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 欧乌头碱 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 欧乌头碱?
The CAS number of 欧乌头碱 is 5008-52-6.
What is the molecular formula of 欧乌头碱?
The molecular formula of 欧乌头碱 is C19H29NO2.
What is the molecular weight of 欧乌头碱?
The molecular weight of 欧乌头碱 is 303.22 g/mol.
Where can I buy 欧乌头碱?
You can request a quote for 欧乌头碱 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 欧乌头碱?
Yes, KEHONG BIO provides custom synthesis services for 欧乌头碱 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.