鸭嘴花碱
TL;DR: 鸭嘴花碱 (CAS 6159-56-4) is a chemical compound with molecular formula C11H12N2O and molecular weight 188.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
鸭嘴花碱
1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-3-ol
Also Known As: Vasicine, Peganine, (+/-)-Vasicine, l-Peganine, Vasicine, dl-
| Molecular Formula | C11H12N2O |
|---|---|
| Molecular Weight | 188.09 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 35.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 188.09496 |
| Heavy Atoms | 14 |
| Complexity | 264.0 |
Chemical Identifiers
| CAS Number | 6159-56-4 |
|---|---|
| SMILES | C1CN2CC3=CC=CC=C3N=C2C1O |
| InChIKey | YIICVSCAKJMMDJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
鸭嘴花碱 (CAS 6159-56-4), with molecular formula C11H12N2O and molecular weight 188.09 g/mol. IUPAC: 1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-3-ol.
Chemical Property Profile of 鸭嘴花碱
Property Insights of 鸭嘴花碱
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 鸭嘴花碱. With a topological polar surface area (TPSA) of 35.8 Ų, 鸭嘴花碱 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 鸭嘴花碱 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 鸭嘴花碱?
The CAS number of 鸭嘴花碱 is 6159-56-4.
What is the molecular formula of 鸭嘴花碱?
The molecular formula of 鸭嘴花碱 is C11H12N2O.
What is the molecular weight of 鸭嘴花碱?
The molecular weight of 鸭嘴花碱 is 188.09 g/mol.
Where can I buy 鸭嘴花碱?
You can request a quote for 鸭嘴花碱 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 鸭嘴花碱?
Yes, KEHONG BIO provides custom synthesis services for 鸭嘴花碱 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.