山麻杆碱
TL;DR: 山麻杆碱 (CAS 34079-63-5) is a chemical compound with molecular formula C12H19N3O and molecular weight 221.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
山麻杆碱
(2R)-1-methoxy-7,7-dimethyl-2-prop-1-en-2-yl-2,3-dihydroimidazo[1,2-a]pyrimidine
Also Known As: Alchorneine, KST-1A3964, (2r)-1-methoxy-7,7-dimethyl-2-(prop-1-en-2-yl)-1,2,3,7-tetrahydroimidazo[1,2-a]pyrimidine, (2R)-1,2,3,7-Tetrahydro-1-methoxy-7,7-dimethyl-2-(1-methylethenyl)imidazo(1,2-a)pyrimidine, (2R)-1-methoxy-7,7-dimethyl-2-prop-1-en-2-yl-2,3-dihydroimidazo[1,2-a]pyrimidine
| Molecular Formula | C12H19N3O |
|---|---|
| Molecular Weight | 221.15 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 28.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 221.15282 |
| Heavy Atoms | 16 |
| Complexity | 370.0 |
Chemical Identifiers
| CAS Number | 34079-63-5 |
|---|---|
| SMILES | CC(=C)[C@@H]1CN2C=CC(N=C2N1OC)(C)C |
| InChIKey | RCNXAKUMTKVCLL-JTQLQIEISA-N |
Product Overview
山麻杆碱 (CAS 34079-63-5), with molecular formula C12H19N3O and molecular weight 221.15 g/mol. IUPAC: (2R)-1-methoxy-7,7-dimethyl-2-prop-1-en-2-yl-2,3-dihydroimidazo[1,2-a]pyrimidine.
Chemical Property Profile of 山麻杆碱
Property Insights of 山麻杆碱
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 山麻杆碱. With a topological polar surface area (TPSA) of 28.1 Ų, 山麻杆碱 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 山麻杆碱 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 山麻杆碱?
The CAS number of 山麻杆碱 is 34079-63-5.
What is the molecular formula of 山麻杆碱?
The molecular formula of 山麻杆碱 is C12H19N3O.
What is the molecular weight of 山麻杆碱?
The molecular weight of 山麻杆碱 is 221.15 g/mol.
Where can I buy 山麻杆碱?
You can request a quote for 山麻杆碱 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 山麻杆碱?
Yes, KEHONG BIO provides custom synthesis services for 山麻杆碱 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.