N-benzyl-8-(1,2,3,4,7,7-hexachloro-6-octyl-5-bicyclo[2.2.1]hept-2-enyl)octanamide
TL;DR: N-benzyl-8-(1,2,3,4,7,7-hexachloro-6-octyl-5-bicyclo[2.2.1]hept-2-enyl)octanamide (CAS 405923-50-4) is a chemical compound with molecular formula C30H41Cl6NO and molecular weight 641.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-8-(1,4,5,6,7,7-hexachloro-3-octyl-2-bicyclo[2.2.1]hept-5-enyl)octanamide
Also Known As: N-benzyl-8-(1,2,3,4,7,7-hexachloro-6-octyl-5-bicyclo[2.2.1]hept-2-enyl)octanamide, n-benzyl-8-(1,4,5,6,7,7-hexachloro-3-octylbicyclo[2.2.1]hept-5-en-2-yl)octanamide, N-benzyl-8-(1,2,3,4,7,7-hexachloro-6-octyl-5-bicyclo[2.2.1]h
| Molecular Formula | C30H41Cl6NO |
|---|---|
| Molecular Weight | 641.13 g/mol |
| LogP | 11.3 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 17 |
| Exact Mass | 641.13196 |
| Heavy Atoms | 38 |
| Complexity | 798.0 |
Chemical Identifiers
| CAS Number | 405923-50-4 |
|---|---|
| SMILES | CCCCCCCCC1C(C2(C(=C(C1(C2(Cl)Cl)Cl)Cl)Cl)Cl)CCCCCCCC(=O)NCC3=CC=CC=C3 |
| InChIKey | DDPVTGQLSRHOBM-UHFFFAOYSA-N |
Product Overview
N-benzyl-8-(1,2,3,4,7,7-hexachloro-6-octyl-5-bicyclo[2.2.1]hept-2-enyl)octanamide (CAS 405923-50-4), with molecular formula C30H41Cl6NO and molecular weight 641.13 g/mol. IUPAC: N-benzyl-8-(1,4,5,6,7,7-hexachloro-3-octyl-2-bicyclo[2.2.1]hept-5-enyl)octanamide.
Chemical Property Profile of N-benzyl-8-(1,2,3,4,7,7-hexachloro-6-octyl-5-bicyclo[2.2.1]hept-2-enyl)octanamide
Property Insights of N-benzyl-8-(1,2,3,4,7,7-hexachloro-6-octyl-5-bicyclo[2.2.1]hept-2-enyl)octanamide
The XLogP value of 11.3 indicates that N-benzyl-8-(1,2,3,4,7,7-hexachloro-6-octyl-5-bicyclo[2.2.1]hept-2-enyl)octanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, N-benzyl-8-(1,2,3,4,7,7-hexachloro-6-octyl-5-bicyclo[2.2.1]hept-2-enyl)octanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-benzyl-8-(1,2,3,4,7,7-hexachloro-6-octyl-5-bicyclo[2.2.1]hept-2-enyl)octanamide has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-benzyl-8-(1,2,3,4,7,7-hexachloro-6-octyl-5-bicyclo[2.2.1]hept-2-enyl)octanamide?
The CAS number of N-benzyl-8-(1,2,3,4,7,7-hexachloro-6-octyl-5-bicyclo[2.2.1]hept-2-enyl)octanamide is 405923-50-4.
What is the molecular formula of N-benzyl-8-(1,2,3,4,7,7-hexachloro-6-octyl-5-bicyclo[2.2.1]hept-2-enyl)octanamide?
The molecular formula of N-benzyl-8-(1,2,3,4,7,7-hexachloro-6-octyl-5-bicyclo[2.2.1]hept-2-enyl)octanamide is C30H41Cl6NO.
What is the molecular weight of N-benzyl-8-(1,2,3,4,7,7-hexachloro-6-octyl-5-bicyclo[2.2.1]hept-2-enyl)octanamide?
The molecular weight of N-benzyl-8-(1,2,3,4,7,7-hexachloro-6-octyl-5-bicyclo[2.2.1]hept-2-enyl)octanamide is 641.13 g/mol.
Where can I buy N-benzyl-8-(1,2,3,4,7,7-hexachloro-6-octyl-5-bicyclo[2.2.1]hept-2-enyl)octanamide?
You can request a quote for N-benzyl-8-(1,2,3,4,7,7-hexachloro-6-octyl-5-bicyclo[2.2.1]hept-2-enyl)octanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzyl-8-(1,2,3,4,7,7-hexachloro-6-octyl-5-bicyclo[2.2.1]hept-2-enyl)octanamide?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-8-(1,2,3,4,7,7-hexachloro-6-octyl-5-bicyclo[2.2.1]hept-2-enyl)octanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.