RefChem:1064232
TL;DR: RefChem:1064232 (CAS 74303-06-3) is a chemical compound with molecular formula C38H52N4O8 and molecular weight 692.38 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-but-2-enedioic acid;bis(1-(tert-butylamino)-3-[2-(1H-pyrrol-2-yl)phenoxy]propan-2-ol)
Also Known As: 2-(2-(3-tert-Butylamino-2-hydroxypropoxy)-phenyl)-pyrrol-fumarat [German], 2-(2-(3-tert-Butylamino-2-hydroxypropoxy)-phenyl)-pyrrol-fumarat, 2-Propanol, 1-((1,1-dimethylethyl)amino)-3-(2-(1H-pyrrol-2-yl)phenoxy)-, (E)-2-butenedioate (2:1) (salt), (E)-but-2-enedioic acid; 1-(tert-butylamino)-3-[2-(1H-pyrrol-2-yl)phenoxy]propan-2-ol, RefChem:1064232
| Molecular Formula | C38H52N4O8 |
|---|---|
| Molecular Weight | 692.38 g/mol |
| LogP | 5.3308 |
| Topological Polar Surface Area | 189.16 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 14 |
| Exact Mass | 692.37854 |
| Heavy Atoms | 50 |
| Complexity | 1455.034 |
Chemical Identifiers
| CAS Number | 74303-06-3 |
|---|---|
| SMILES | CC(C)(C)NCC(COC1=CC=CC=C1C2=CC=CN2)O.CC(C)(C)NCC(COC1=CC=CC=C1C2=CC=CN2)O.C(=C/C(=O)O)\C(=O)O |
Product Overview
RefChem:1064232 (CAS 74303-06-3), with molecular formula C38H52N4O8 and molecular weight 692.38 g/mol. IUPAC: (E)-but-2-enedioic acid;bis(1-(tert-butylamino)-3-[2-(1H-pyrrol-2-yl)phenoxy]propan-2-ol).
Chemical Property Profile of RefChem:1064232
Property Insights of RefChem:1064232
The XLogP value of 5.3308 indicates that RefChem:1064232 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 189.16 Ų indicates high polarity, suggesting RefChem:1064232 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:1064232 has 8 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1064232?
The CAS number of RefChem:1064232 is 74303-06-3.
What is the molecular formula of RefChem:1064232?
The molecular formula of RefChem:1064232 is C38H52N4O8.
What is the molecular weight of RefChem:1064232?
The molecular weight of RefChem:1064232 is 692.38 g/mol.
Where can I buy RefChem:1064232?
You can request a quote for RefChem:1064232 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1064232?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1064232 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.