A1543/0067117
TL;DR: A1543/0067117 (CAS 311792-68-4) is a chemical compound with molecular formula C39H21N5O6 and molecular weight 655.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-ethynylphenyl)-2-[6-[5-[(3-ethynylphenyl)carbamoyl]-1,3-dioxoisoindol-2-yl]-2-pyridinyl]-1,3-dioxoisoindole-5-carboxamide
Also Known As: A1543/0067117, N-(3-ethynylphenyl)-2-[6-[5-[(3-ethynylphenyl)carbamoyl]-1,3-dioxoisoindol-2-yl]pyridin-2-yl]-1,3-dioxoisoindole-5-carboxamide, 2,2'-pyridine-2,6-diylbis[N-(3-ethynylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxamide], N-(3-ETHYNYLPHENYL)-2-(6-{5-[(3-ETHYNYLPHENYL)CARBAMOYL]-1,3-DIOXO-2,3-DIHYDRO-1H-ISOINDOL-2-YL}PYRIDIN-2-YL)-1,3-DIOXO-2,3-DIHYDRO-1H-ISOINDOLE-5-CARBOXAMIDE, N-(3-ethynylphenyl)[2-(6-{5-[N-(3-ethynylphenyl)carbamoyl]-1,3-dioxobenzo[c]az olin-2-yl}(2-pyridyl))-1,3-dioxobenzo[c]azolin-5-yl]carboxamide
| Molecular Formula | C39H21N5O6 |
|---|---|
| Molecular Weight | 655.15 g/mol |
| LogP | 5.15 |
| Topological Polar Surface Area | 145.85 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 655.1492 |
| Heavy Atoms | 50 |
| Complexity | 2288.0396 |
Chemical Identifiers
| CAS Number | 311792-68-4 |
|---|---|
| SMILES | C#CC1=CC(=CC=C1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=NC(=CC=C4)N5C(=O)C6=C(C5=O)C=C(C=C6)C(=O)NC7=CC=CC(=C7)C#C |
Product Overview
A1543/0067117 (CAS 311792-68-4), with molecular formula C39H21N5O6 and molecular weight 655.15 g/mol. IUPAC: N-(3-ethynylphenyl)-2-[6-[5-[(3-ethynylphenyl)carbamoyl]-1,3-dioxoisoindol-2-yl]-2-pyridinyl]-1,3-dioxoisoindole-5-carboxamide.
Chemical Property Profile of A1543/0067117
Property Insights of A1543/0067117
The XLogP value of 5.15 indicates that A1543/0067117 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 145.85 Ų indicates high polarity, suggesting A1543/0067117 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, A1543/0067117 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A1543/0067117?
The CAS number of A1543/0067117 is 311792-68-4.
What is the molecular formula of A1543/0067117?
The molecular formula of A1543/0067117 is C39H21N5O6.
What is the molecular weight of A1543/0067117?
The molecular weight of A1543/0067117 is 655.15 g/mol.
Where can I buy A1543/0067117?
You can request a quote for A1543/0067117 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1543/0067117?
Yes, KEHONG BIO provides custom synthesis services for A1543/0067117 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.