(Cytisin-12-yl)acetamide
TL;DR: (Cytisin-12-yl)acetamide (CAS 138867-34-2) is a chemical compound with molecular formula C13H17N3O2 and molecular weight 247.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(1R,9S)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl]acetamide
Also Known As: (Cytisin-12-yl)acetamide, (-)-12-Cytisineacetamide, (1R,5S)-1,5,6,8-Tetrahydro-8-oxo-1,5-methano-2H-pyrido[1,2-a][1,5]diazocine-3(4H)-acetamide, 2-[(1R,9S)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl]acetamide, (1R,5S)-1,5,6,8-Tetrahydro-8-oxo-1,5-methano-2H-pyrido(1,2-a)(1,5)diazocine-3(4H)-acetamide
| Molecular Formula | C13H17N3O2 |
|---|---|
| Molecular Weight | 247.13 g/mol |
| LogP | -0.2473 |
| Topological Polar Surface Area | 68.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 247.13208 |
| Heavy Atoms | 18 |
| Complexity | 537.283 |
Chemical Identifiers
| CAS Number | 138867-34-2 |
|---|---|
| SMILES | C1[C@H]2CN(C[C@@H]1C3=CC=CC(=O)N3C2)CC(=O)N |
Product Overview
(Cytisin-12-yl)acetamide (CAS 138867-34-2), with molecular formula C13H17N3O2 and molecular weight 247.13 g/mol. IUPAC: 2-[(1R,9S)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl]acetamide.
Chemical Property Profile of (Cytisin-12-yl)acetamide
Property Insights of (Cytisin-12-yl)acetamide
The XLogP value of -0.2473 indicates that (Cytisin-12-yl)acetamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 68.33 Ų falls within the moderate polarity range, balancing permeability and solubility for (Cytisin-12-yl)acetamide. Following Lipinski's Rule of Five, (Cytisin-12-yl)acetamide has 1 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 (Cytisin-12-yl)acetamide?
The CAS number of (Cytisin-12-yl)acetamide is 138867-34-2.
What is the molecular formula of (Cytisin-12-yl)acetamide?
The molecular formula of (Cytisin-12-yl)acetamide is C13H17N3O2.
What is the molecular weight of (Cytisin-12-yl)acetamide?
The molecular weight of (Cytisin-12-yl)acetamide is 247.13 g/mol.
Where can I buy (Cytisin-12-yl)acetamide?
You can request a quote for (Cytisin-12-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Cytisin-12-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for (Cytisin-12-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.