RefChem:513211
TL;DR: RefChem:513211 (CAS 618074-65-0) is a chemical compound with molecular formula C29H29FN2O5 and molecular weight 504.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[(3-fluoro-4-methoxyphenyl)-hydroxymethylidene]-5-(4-pentoxyphenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
Also Known As: 4-(3-Fluoro-4-methoxybenzoyl)-3-hydroxy-5-(4-(pentyloxy)phenyl)-1-(pyridin-3-ylmethyl)-1H-pyrrol-2(5H)-one, 4-(3-FLUORO-4-METHOXYBENZOYL)-3-HYDROXY-5-[4-(PENTYLOXY)PHENYL]-1-(3-PYRIDINYLMETHYL)-1,5-DIHYDRO-2H-PYRROL-2-ONE, 4-(3-Fluoro-4-methoxybenzoyl)-3-hydroxy-5-(4-(pentyloxy)phenyl)-1-(3-pyridinylmethyl)-1,5-dihydro-2H-pyrrol-2-one, 645-643-3, RefChem:513211
| Molecular Formula | C29H29FN2O5 |
|---|---|
| Molecular Weight | 504.21 g/mol |
| LogP | 5.4202 |
| Topological Polar Surface Area | 88.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 504.20605 |
| Heavy Atoms | 37 |
| Complexity | 1291.4089 |
Chemical Identifiers
| CAS Number | 618074-65-0 |
|---|---|
| SMILES | CCCCCOC1=CC=C(C=C1)C2/C(=C(/C3=CC(=C(C=C3)OC)F)\O)/C(=O)C(=O)N2CC4=CN=CC=C4 |
Product Overview
RefChem:513211 (CAS 618074-65-0), with molecular formula C29H29FN2O5 and molecular weight 504.21 g/mol. IUPAC: (4E)-4-[(3-fluoro-4-methoxyphenyl)-hydroxymethylidene]-5-(4-pentoxyphenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione.
Chemical Property Profile of RefChem:513211
Property Insights of RefChem:513211
The XLogP value of 5.4202 indicates that RefChem:513211 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.96 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:513211. Following Lipinski's Rule of Five, RefChem:513211 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:513211?
The CAS number of RefChem:513211 is 618074-65-0.
What is the molecular formula of RefChem:513211?
The molecular formula of RefChem:513211 is C29H29FN2O5.
What is the molecular weight of RefChem:513211?
The molecular weight of RefChem:513211 is 504.21 g/mol.
Where can I buy RefChem:513211?
You can request a quote for RefChem:513211 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:513211?
Yes, KEHONG BIO provides custom synthesis services for RefChem:513211 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.