RefChem:530111
TL;DR: RefChem:530111 (CAS 618081-01-9) is a chemical compound with molecular formula C30H31NO7 and molecular weight 517.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[(3,4-dimethoxyphenyl)-hydroxymethylidene]-1-(3-methoxypropyl)-5-(4-phenylmethoxyphenyl)pyrrolidine-2,3-dione
Also Known As: 5-(4-(Benzyloxy)phenyl)-4-(3,4-dimethoxybenzoyl)-3-hydroxy-1-(3-methoxypropyl)-1H-pyrrol-2(5H)-one, 5-(4-(Benzyloxy)phenyl)-4-(3,4-dimethoxybenzoyl)-3-hydroxy-1-(3-methoxypropyl)-1,5-dihydro-2H-pyrrol-2-one, 5-[4-(BENZYLOXY)PHENYL]-4-(3,4-DIMETHOXYBENZOYL)-3-HYDROXY-1-(3-METHOXYPROPYL)-1,5-DIHYDRO-2H-PYRROL-2-ONE, 645-589-0, RefChem:530111
| Molecular Formula | C30H31NO7 |
|---|---|
| Molecular Weight | 517.21 g/mol |
| LogP | 4.741 |
| Topological Polar Surface Area | 94.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 517.21 |
| Heavy Atoms | 38 |
| Complexity | 1301.9365 |
Chemical Identifiers
| CAS Number | 618081-01-9 |
|---|---|
| SMILES | COCCCN1C(/C(=C(/C2=CC(=C(C=C2)OC)OC)\O)/C(=O)C1=O)C3=CC=C(C=C3)OCC4=CC=CC=C4 |
Product Overview
RefChem:530111 (CAS 618081-01-9), with molecular formula C30H31NO7 and molecular weight 517.21 g/mol. IUPAC: (4E)-4-[(3,4-dimethoxyphenyl)-hydroxymethylidene]-1-(3-methoxypropyl)-5-(4-phenylmethoxyphenyl)pyrrolidine-2,3-dione.
Chemical Property Profile of RefChem:530111
Property Insights of RefChem:530111
The XLogP value of 4.741 indicates that RefChem:530111 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.53 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:530111. Following Lipinski's Rule of Five, RefChem:530111 has 1 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 RefChem:530111?
The CAS number of RefChem:530111 is 618081-01-9.
What is the molecular formula of RefChem:530111?
The molecular formula of RefChem:530111 is C30H31NO7.
What is the molecular weight of RefChem:530111?
The molecular weight of RefChem:530111 is 517.21 g/mol.
Where can I buy RefChem:530111?
You can request a quote for RefChem:530111 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:530111?
Yes, KEHONG BIO provides custom synthesis services for RefChem:530111 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.