RefChem:327252
TL;DR: RefChem:327252 (CAS 85826-18-2) is a chemical compound with molecular formula C41H46N6O6 and molecular weight 718.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diethylamino)ethyl 4-[[4-[4-[2-(diethylamino)ethoxycarbonyl]phenoxy]-6-(N-phenylanilino)-1,3,5-triazin-2-yl]oxy]benzoate
Also Known As: Benzoic acid, 4,4'-((6-(diphenylamino)-1,3,5-triazine-2,4-diyl)bis(oxy))bis-, bis(2-(diethylamino)ethyl) ester, 2-Diethylaminoethyl4-[[4-[4-(2-diethylaminoethyloxycarbonyl)phenoxy]-6-(N-phenylanilino)-1,3,5-triazin-2-yl]oxy]benzoate, 2-diethylaminoethyl 4-[[4-[4-(2-diethylaminoethyloxycarbonyl)phenoxy]-6-(N-phenylanilino)-1,3,5-triazin-2-yl]oxy]benzoate, bis[2-(diethylamino)ethyl] 4,4'-{[6-(diphenylamino)-1,3,5-triazine-2,4-diyl]bis(oxy)}dibenzoate, RefChem:327252
| Molecular Formula | C41H46N6O6 |
|---|---|
| Molecular Weight | 718.35 g/mol |
| LogP | 8.5 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 21 |
| Exact Mass | 718.3479 |
| Heavy Atoms | 53 |
| Complexity | 958.0 |
Chemical Identifiers
| CAS Number | 85826-18-2 |
|---|---|
| SMILES | CCN(CC)CCOC(=O)C1=CC=C(C=C1)OC2=NC(=NC(=N2)N(C3=CC=CC=C3)C4=CC=CC=C4)OC5=CC=C(C=C5)C(=O)OCCN(CC)CC |
| InChIKey | NOWUKGZJJGESCP-UHFFFAOYSA-N |
Product Overview
RefChem:327252 (CAS 85826-18-2), with molecular formula C41H46N6O6 and molecular weight 718.35 g/mol. IUPAC: 2-(diethylamino)ethyl 4-[[4-[4-[2-(diethylamino)ethoxycarbonyl]phenoxy]-6-(N-phenylanilino)-1,3,5-triazin-2-yl]oxy]benzoate.
Chemical Property Profile of RefChem:327252
Property Insights of RefChem:327252
The XLogP value of 8.5 indicates that RefChem:327252 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:327252. Following Lipinski's Rule of Five, RefChem:327252 has 0 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:327252?
The CAS number of RefChem:327252 is 85826-18-2.
What is the molecular formula of RefChem:327252?
The molecular formula of RefChem:327252 is C41H46N6O6.
What is the molecular weight of RefChem:327252?
The molecular weight of RefChem:327252 is 718.35 g/mol.
Where can I buy RefChem:327252?
You can request a quote for RefChem:327252 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:327252?
Yes, KEHONG BIO provides custom synthesis services for RefChem:327252 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.