C40H42N6O2
TL;DR: C40H42N6O2 (CAS 130189-73-0) is a chemical compound with molecular formula C40H42N6O2 and molecular weight 638.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[6,12-diphenyl-2-[(2-piperidin-1-ylacetyl)amino]benzo[c][1,5]benzodiazocin-8-yl]-2-piperidin-1-ylacetamide
Also Known As: 2,8-Di(piperidinoacetamido)-6,12-diphenyldibenzo(b,f)(1,5)diazocine, 1-Piperidineacetamide, N,N'-(6,12-diphenyldibenzo(b,f)(1,5)diazocine-2,8-diyl)bis-, N,N'-(6,12-diphenyldibenzo[b,f][1,5]diazocine-2,8-diyl)bis[2-(piperidin-1-yl)acetamide], N,N'-((5Z,11Z)-6,12-diphenyldibenzo[b,f][1,5]diazocine-2,8-diyl)bis(2-(piperidin-1-yl)acetamide), N,N'-(6,12-Diphenyldibenzo[b,f][1,5]diazocine-2,8-diyl)bis[(piperidin-1-yl)ethanimidic acid]
| Molecular Formula | C40H42N6O2 |
|---|---|
| Molecular Weight | 638.34 g/mol |
| LogP | 3.8014 |
| Topological Polar Surface Area | 89.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 638.3369 |
| Heavy Atoms | 48 |
| Complexity | 1884.0043 |
Chemical Identifiers
| CAS Number | 130189-73-0 |
|---|---|
| SMILES | C1CCN(CC1)CC(=O)NC2=CC3=C(N=C4C=CC(=CC4=C(N=C3C=C2)C5=CC=CC=C5)NC(=O)CN6CCCCC6)C7=CC=CC=C7 |
Product Overview
C40H42N6O2 (CAS 130189-73-0), with molecular formula C40H42N6O2 and molecular weight 638.34 g/mol. IUPAC: N-[6,12-diphenyl-2-[(2-piperidin-1-ylacetyl)amino]benzo[c][1,5]benzodiazocin-8-yl]-2-piperidin-1-ylacetamide.
Chemical Property Profile of C40H42N6O2
Property Insights of C40H42N6O2
The XLogP value of 3.8014 indicates that C40H42N6O2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.4 Ų falls within the moderate polarity range, balancing permeability and solubility for C40H42N6O2. Following Lipinski's Rule of Five, C40H42N6O2 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C40H42N6O2?
The CAS number of C40H42N6O2 is 130189-73-0.
What is the molecular formula of C40H42N6O2?
The molecular formula of C40H42N6O2 is C40H42N6O2.
What is the molecular weight of C40H42N6O2?
The molecular weight of C40H42N6O2 is 638.34 g/mol.
Where can I buy C40H42N6O2?
You can request a quote for C40H42N6O2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C40H42N6O2?
Yes, KEHONG BIO provides custom synthesis services for C40H42N6O2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.