Vasicine hydrochloride
TL;DR: Vasicine hydrochloride (CAS 7174-27-8) is a chemical compound with molecular formula C11H13ClN2O and molecular weight 224.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-3-ol;hydrochloride
Also Known As: Vasicine hydrochloride, Linarine hydrochloride, Peganine HCl, Vasicine HCl, Peganine hydrochloride
| Molecular Formula | C11H13ClN2O |
|---|---|
| Molecular Weight | 224.07 g/mol |
| LogP | 1.7186 |
| Topological Polar Surface Area | 35.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 224.07164 |
| Heavy Atoms | 15 |
| Complexity | 264.0 |
Chemical Identifiers
| CAS Number | 7174-27-8 |
|---|---|
| SMILES | C1CN2CC3=CC=CC=C3N=C2[C@H]1O.Cl |
| InChIKey | CSDQSAHJCAKJPT-PPHPATTJSA-N |
Product Overview
Vasicine hydrochloride (CAS 7174-27-8), with molecular formula C11H13ClN2O and molecular weight 224.07 g/mol. IUPAC: (3S)-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-3-ol;hydrochloride.
Chemical Property Profile of Vasicine hydrochloride
Property Insights of Vasicine hydrochloride
The XLogP value of 1.7186 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Vasicine hydrochloride. With a topological polar surface area (TPSA) of 35.8 Ų, Vasicine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Vasicine hydrochloride has 2 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 Vasicine hydrochloride?
The CAS number of Vasicine hydrochloride is 7174-27-8.
What is the molecular formula of Vasicine hydrochloride?
The molecular formula of Vasicine hydrochloride is C11H13ClN2O.
What is the molecular weight of Vasicine hydrochloride?
The molecular weight of Vasicine hydrochloride is 224.07 g/mol.
Where can I buy Vasicine hydrochloride?
You can request a quote for Vasicine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Vasicine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Vasicine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.