![N-((1S,5R)-2-acetyl-6,6-dimethylbicyclo[3.1.0]hex-2-en-3-yl)-2,6-dichloronicotinamide structure](/static/products/459/459155-51-2.png)
N-((1S,5R)-2-acetyl-6,6-dimethylbicyclo[3.1.0]hex-2-en-3-yl)-2,6-dichloronicotinamide
TL;DR: N-((1S,5R)-2-acetyl-6,6-dimethylbicyclo[3.1.0]hex-2-en-3-yl)-2,6-dichloronicotinamide (CAS 459155-51-2) is a chemical compound with molecular formula C16H16Cl2N2O2 and molecular weight 338.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(1S,5R)-2-acetyl-6,6-dimethyl-3-bicyclo[3.1.0]hex-2-enyl]-2,6-dichloropyridine-3-carboxamide
Also Known As: N-((1S,5R)-2-acetyl-6,6-dimethylbicyclo[3.1.0]hex-2-en-3-yl)-2,6-dichloronicotinamide, N-[(1R,5S)-4-acetyl-6,6-dimethyl-3-bicyclo[3.1.0]hex-3-enyl]-2,6-dichloropyridine-3-carboxamide
| Molecular Formula | C16H16Cl2N2O2 |
|---|---|
| Molecular Weight | 338.06 g/mol |
| LogP | 3.6372 |
| Topological Polar Surface Area | 59.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 338.05887 |
| Heavy Atoms | 22 |
| Complexity | 724.856 |
Chemical Identifiers
| CAS Number | 459155-51-2 |
|---|---|
| SMILES | CC(=O)C1=C(C[C@@H]2[C@H]1C2(C)C)NC(=O)C3=C(N=C(C=C3)Cl)Cl |
Product Overview
N-((1S,5R)-2-acetyl-6,6-dimethylbicyclo[3.1.0]hex-2-en-3-yl)-2,6-dichloronicotinamide (CAS 459155-51-2), with molecular formula C16H16Cl2N2O2 and molecular weight 338.06 g/mol. IUPAC: N-[(1S,5R)-2-acetyl-6,6-dimethyl-3-bicyclo[3.1.0]hex-2-enyl]-2,6-dichloropyridine-3-carboxamide.
Chemical Property Profile of N-((1S,5R)-2-acetyl-6,6-dimethylbicyclo[3.1.0]hex-2-en-3-yl)-2,6-dichloronicotinamide
Property Insights of N-((1S,5R)-2-acetyl-6,6-dimethylbicyclo[3.1.0]hex-2-en-3-yl)-2,6-dichloronicotinamide
The XLogP value of 3.6372 indicates that N-((1S,5R)-2-acetyl-6,6-dimethylbicyclo[3.1.0]hex-2-en-3-yl)-2,6-dichloronicotinamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.06 Ų, N-((1S,5R)-2-acetyl-6,6-dimethylbicyclo[3.1.0]hex-2-en-3-yl)-2,6-dichloronicotinamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-((1S,5R)-2-acetyl-6,6-dimethylbicyclo[3.1.0]hex-2-en-3-yl)-2,6-dichloronicotinamide 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 N-((1S,5R)-2-acetyl-6,6-dimethylbicyclo[3.1.0]hex-2-en-3-yl)-2,6-dichloronicotinamide?
The CAS number of N-((1S,5R)-2-acetyl-6,6-dimethylbicyclo[3.1.0]hex-2-en-3-yl)-2,6-dichloronicotinamide is 459155-51-2.
What is the molecular formula of N-((1S,5R)-2-acetyl-6,6-dimethylbicyclo[3.1.0]hex-2-en-3-yl)-2,6-dichloronicotinamide?
The molecular formula of N-((1S,5R)-2-acetyl-6,6-dimethylbicyclo[3.1.0]hex-2-en-3-yl)-2,6-dichloronicotinamide is C16H16Cl2N2O2.
What is the molecular weight of N-((1S,5R)-2-acetyl-6,6-dimethylbicyclo[3.1.0]hex-2-en-3-yl)-2,6-dichloronicotinamide?
The molecular weight of N-((1S,5R)-2-acetyl-6,6-dimethylbicyclo[3.1.0]hex-2-en-3-yl)-2,6-dichloronicotinamide is 338.06 g/mol.
Where can I buy N-((1S,5R)-2-acetyl-6,6-dimethylbicyclo[3.1.0]hex-2-en-3-yl)-2,6-dichloronicotinamide?
You can request a quote for N-((1S,5R)-2-acetyl-6,6-dimethylbicyclo[3.1.0]hex-2-en-3-yl)-2,6-dichloronicotinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-((1S,5R)-2-acetyl-6,6-dimethylbicyclo[3.1.0]hex-2-en-3-yl)-2,6-dichloronicotinamide?
Yes, KEHONG BIO provides custom synthesis services for N-((1S,5R)-2-acetyl-6,6-dimethylbicyclo[3.1.0]hex-2-en-3-yl)-2,6-dichloronicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.