RefChem:1064239
TL;DR: RefChem:1064239 (CAS 74303-08-5) is a chemical compound with molecular formula C36H48N4O8 and molecular weight 664.35 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-(propan-2-ylamino)-3-[2-(1H-pyrrol-2-yl)phenoxy]propan-2-ol)
Also Known As: 2-(2-(3-Isopropylamino-2-hydroxypropoxy)-phenyl)-pyrrol-fumarat-hemihydrat [German], 2-Propanol, 1-((1-methylethyl)amino)-3-(2-(1H-pyrrol-2-yl)phenoxy)-, (E)-2-butenedioate (2:1) (salt), 2-(2-(3-Isopropylamino-2-hydroxypropoxy)-phenyl)-pyrrol-fumarat-hemihydrat, (E)-but-2-enedioic acid; 1-(propan-2-ylamino)-3-[2-(1H-pyrrol-2-yl)phenoxy]propan-2-ol, RefChem:1064239
| Molecular Formula | C36H48N4O8 |
|---|---|
| Molecular Weight | 664.35 g/mol |
| LogP | 4.5506 |
| Topological Polar Surface Area | 189.16 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 16 |
| Exact Mass | 664.3472 |
| Heavy Atoms | 48 |
| Complexity | 1375.6742 |
Chemical Identifiers
| CAS Number | 74303-08-5 |
|---|---|
| SMILES | CC(C)NCC(COC1=CC=CC=C1C2=CC=CN2)O.CC(C)NCC(COC1=CC=CC=C1C2=CC=CN2)O.C(=C/C(=O)O)\C(=O)O |
Product Overview
RefChem:1064239 (CAS 74303-08-5), with molecular formula C36H48N4O8 and molecular weight 664.35 g/mol. IUPAC: (E)-but-2-enedioic acid;bis(1-(propan-2-ylamino)-3-[2-(1H-pyrrol-2-yl)phenoxy]propan-2-ol).
Chemical Property Profile of RefChem:1064239
Property Insights of RefChem:1064239
The XLogP value of 4.5506 indicates that RefChem:1064239 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 189.16 Ų indicates high polarity, suggesting RefChem:1064239 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:1064239 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:1064239?
The CAS number of RefChem:1064239 is 74303-08-5.
What is the molecular formula of RefChem:1064239?
The molecular formula of RefChem:1064239 is C36H48N4O8.
What is the molecular weight of RefChem:1064239?
The molecular weight of RefChem:1064239 is 664.35 g/mol.
Where can I buy RefChem:1064239?
You can request a quote for RefChem:1064239 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1064239?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1064239 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.