狭叶羽扇豆碱
TL;DR: 狭叶羽扇豆碱 (CAS 550-43-6) is a chemical compound with molecular formula C14H22N2O and molecular weight 234.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
狭叶羽扇豆碱
(1R,2R,9S,10S)-10-prop-2-enyl-7,11-diazatricyclo[7.3.1.02,7]tridecan-6-one
Also Known As: Angustifoline, 4-(Prop-2-en-1-yl)decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one, (1R,2R,9S,10S)-10-Prop-2-enyl-7,11-diazatricyclo[7.3.1.02,7]tridecan-6-one, (1R,4S,5S,11aR)-4-(Prop-2-en-1-yl)decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
| Molecular Formula | C14H22N2O |
|---|---|
| Molecular Weight | 234.17 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 234.17322 |
| Heavy Atoms | 17 |
| Complexity | 328.0 |
Chemical Identifiers
| CAS Number | 550-43-6 |
|---|---|
| SMILES | C=CC[C@H]1[C@H]2C[C@H](CN1)[C@H]3CCCC(=O)N3C2 |
| InChIKey | VTIPIBIDDZPDAV-MROQNXINSA-N |
Product Overview
狭叶羽扇豆碱 (CAS 550-43-6), with molecular formula C14H22N2O and molecular weight 234.17 g/mol. IUPAC: (1R,2R,9S,10S)-10-prop-2-enyl-7,11-diazatricyclo[7.3.1.02,7]tridecan-6-one.
Chemical Property Profile of 狭叶羽扇豆碱
Property Insights of 狭叶羽扇豆碱
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 狭叶羽扇豆碱. With a topological polar surface area (TPSA) of 32.3 Ų, 狭叶羽扇豆碱 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 狭叶羽扇豆碱 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 狭叶羽扇豆碱?
The CAS number of 狭叶羽扇豆碱 is 550-43-6.
What is the molecular formula of 狭叶羽扇豆碱?
The molecular formula of 狭叶羽扇豆碱 is C14H22N2O.
What is the molecular weight of 狭叶羽扇豆碱?
The molecular weight of 狭叶羽扇豆碱 is 234.17 g/mol.
Where can I buy 狭叶羽扇豆碱?
You can request a quote for 狭叶羽扇豆碱 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 狭叶羽扇豆碱?
Yes, KEHONG BIO provides custom synthesis services for 狭叶羽扇豆碱 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.