UPCMLD0ENAT5968951:001
TL;DR: UPCMLD0ENAT5968951:001 (CAS 378752-45-5) is a chemical compound with molecular formula C23H22BrFN2O4 and molecular weight 488.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-5-(3-bromophenyl)-4-[(4-fluorophenyl)-hydroxymethylidene]-1-(2-morpholin-4-ylethyl)pyrrolidine-2,3-dione
Also Known As: UPCMLD0ENAT5968951:001, AB00116204-01, 5-(3-bromophenyl)-4-(4-fluorobenzoyl)-3-hydroxy-1-[2-(morpholin-4-yl)ethyl]-2,5-dihydro-1H-pyrrol-2-one, (4E)-5-(3-bromophenyl)-4-[(4-fluorophenyl)-hydroxymethylidene]-1-(2-morpholin-4-ylethyl)pyrrolidine-2,3-dione, 5-(3-bromophenyl)-4-(4-fluorobenzoyl)-3-hydroxy-1-(2-morpholinoethyl)-1H-pyrrol-2(5H)-one
| Molecular Formula | C23H22BrFN2O4 |
|---|---|
| Molecular Weight | 488.07 g/mol |
| LogP | 3.3421 |
| Topological Polar Surface Area | 70.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 488.0747 |
| Heavy Atoms | 31 |
| Complexity | 1018.49146 |
Chemical Identifiers
| CAS Number | 378752-45-5 |
|---|---|
| SMILES | C1COCCN1CCN2C(/C(=C(/C3=CC=C(C=C3)F)\O)/C(=O)C2=O)C4=CC(=CC=C4)Br |
Product Overview
UPCMLD0ENAT5968951:001 (CAS 378752-45-5), with molecular formula C23H22BrFN2O4 and molecular weight 488.07 g/mol. IUPAC: (4E)-5-(3-bromophenyl)-4-[(4-fluorophenyl)-hydroxymethylidene]-1-(2-morpholin-4-ylethyl)pyrrolidine-2,3-dione.
Chemical Property Profile of UPCMLD0ENAT5968951:001
Property Insights of UPCMLD0ENAT5968951:001
The XLogP value of 3.3421 indicates that UPCMLD0ENAT5968951:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.08 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5968951:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5968951:001 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of UPCMLD0ENAT5968951:001?
The CAS number of UPCMLD0ENAT5968951:001 is 378752-45-5.
What is the molecular formula of UPCMLD0ENAT5968951:001?
The molecular formula of UPCMLD0ENAT5968951:001 is C23H22BrFN2O4.
What is the molecular weight of UPCMLD0ENAT5968951:001?
The molecular weight of UPCMLD0ENAT5968951:001 is 488.07 g/mol.
Where can I buy UPCMLD0ENAT5968951:001?
You can request a quote for UPCMLD0ENAT5968951:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5968951:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5968951:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.