![2-[4-[[4-(dicyclohexylamino)-6-[4-(1,3-dioxoisoindol-2-yl)anilino]-1,3,5-triazin-2-yl]amino]phenyl]isoindole-1,3-dione structure](/static/products/7812/78124-04-6.webp)
2-[4-[[4-(dicyclohexylamino)-6-[4-(1,3-dioxoisoindol-2-yl)anilino]-1,3,5-triazin-2-yl]amino]phenyl]isoindole-1,3-dione
TL;DR: 2-[4-[[4-(dicyclohexylamino)-6-[4-(1,3-dioxoisoindol-2-yl)anilino]-1,3,5-triazin-2-yl]amino]phenyl]isoindole-1,3-dione (CAS 78124-04-6) is a chemical compound with molecular formula C43H40N8O4 and molecular weight 732.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[[4-(dicyclohexylamino)-6-[4-(1,3-dioxoisoindol-2-yl)anilino]-1,3,5-triazin-2-yl]amino]phenyl]isoindole-1,3-dione
Also Known As: 2-[4-[[4-(dicyclohexylamino)-6-[4-(1,3-dioxoisoindol-2-yl)anilino]-1,3,5-triazin-2-yl]amino]phenyl]isoindole-1,3-dione, 2-[4-[[4-(dicyclohexylamino)-6-[4-(1,3-dioxoisoindol-2-yl)an, 2,2'-{[6-(Dicyclohexylamino)-1,3,5-triazine-2,4-diyl]bis(azanediyl-4,1-phenylene)}di(1H-isoindole-1,3(2H)-dione)
| Molecular Formula | C43H40N8O4 |
|---|---|
| Molecular Weight | 732.32 g/mol |
| LogP | 8.9 |
| Topological Polar Surface Area | 141.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 732.31726 |
| Heavy Atoms | 55 |
| Complexity | 1240.0 |
Chemical Identifiers
| CAS Number | 78124-04-6 |
|---|---|
| SMILES | C1CCC(CC1)N(C2CCCCC2)C3=NC(=NC(=N3)NC4=CC=C(C=C4)N5C(=O)C6=CC=CC=C6C5=O)NC7=CC=C(C=C7)N8C(=O)C9=CC=CC=C9C8=O |
| InChIKey | FZFGIIJKTCDACJ-UHFFFAOYSA-N |
Product Overview
2-[4-[[4-(dicyclohexylamino)-6-[4-(1,3-dioxoisoindol-2-yl)anilino]-1,3,5-triazin-2-yl]amino]phenyl]isoindole-1,3-dione (CAS 78124-04-6), with molecular formula C43H40N8O4 and molecular weight 732.32 g/mol. IUPAC: 2-[4-[[4-(dicyclohexylamino)-6-[4-(1,3-dioxoisoindol-2-yl)anilino]-1,3,5-triazin-2-yl]amino]phenyl]isoindole-1,3-dione.
Chemical Property Profile of 2-[4-[[4-(dicyclohexylamino)-6-[4-(1,3-dioxoisoindol-2-yl)anilino]-1,3,5-triazin-2-yl]amino]phenyl]isoindole-1,3-dione
Property Insights of 2-[4-[[4-(dicyclohexylamino)-6-[4-(1,3-dioxoisoindol-2-yl)anilino]-1,3,5-triazin-2-yl]amino]phenyl]isoindole-1,3-dione
The XLogP value of 8.9 indicates that 2-[4-[[4-(dicyclohexylamino)-6-[4-(1,3-dioxoisoindol-2-yl)anilino]-1,3,5-triazin-2-yl]amino]phenyl]isoindole-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 141.0 Ų indicates high polarity, suggesting 2-[4-[[4-(dicyclohexylamino)-6-[4-(1,3-dioxoisoindol-2-yl)anilino]-1,3,5-triazin-2-yl]amino]phenyl]isoindole-1,3-dione may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-[4-[[4-(dicyclohexylamino)-6-[4-(1,3-dioxoisoindol-2-yl)anilino]-1,3,5-triazin-2-yl]amino]phenyl]isoindole-1,3-dione has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[4-[[4-(dicyclohexylamino)-6-[4-(1,3-dioxoisoindol-2-yl)anilino]-1,3,5-triazin-2-yl]amino]phenyl]isoindole-1,3-dione?
The CAS number of 2-[4-[[4-(dicyclohexylamino)-6-[4-(1,3-dioxoisoindol-2-yl)anilino]-1,3,5-triazin-2-yl]amino]phenyl]isoindole-1,3-dione is 78124-04-6.
What is the molecular formula of 2-[4-[[4-(dicyclohexylamino)-6-[4-(1,3-dioxoisoindol-2-yl)anilino]-1,3,5-triazin-2-yl]amino]phenyl]isoindole-1,3-dione?
The molecular formula of 2-[4-[[4-(dicyclohexylamino)-6-[4-(1,3-dioxoisoindol-2-yl)anilino]-1,3,5-triazin-2-yl]amino]phenyl]isoindole-1,3-dione is C43H40N8O4.
What is the molecular weight of 2-[4-[[4-(dicyclohexylamino)-6-[4-(1,3-dioxoisoindol-2-yl)anilino]-1,3,5-triazin-2-yl]amino]phenyl]isoindole-1,3-dione?
The molecular weight of 2-[4-[[4-(dicyclohexylamino)-6-[4-(1,3-dioxoisoindol-2-yl)anilino]-1,3,5-triazin-2-yl]amino]phenyl]isoindole-1,3-dione is 732.32 g/mol.
Where can I buy 2-[4-[[4-(dicyclohexylamino)-6-[4-(1,3-dioxoisoindol-2-yl)anilino]-1,3,5-triazin-2-yl]amino]phenyl]isoindole-1,3-dione?
You can request a quote for 2-[4-[[4-(dicyclohexylamino)-6-[4-(1,3-dioxoisoindol-2-yl)anilino]-1,3,5-triazin-2-yl]amino]phenyl]isoindole-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[4-[[4-(dicyclohexylamino)-6-[4-(1,3-dioxoisoindol-2-yl)anilino]-1,3,5-triazin-2-yl]amino]phenyl]isoindole-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-[[4-(dicyclohexylamino)-6-[4-(1,3-dioxoisoindol-2-yl)anilino]-1,3,5-triazin-2-yl]amino]phenyl]isoindole-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.