BAS 03321640
TL;DR: BAS 03321640 (CAS 440096-97-9) is a chemical compound with molecular formula C24H22BrN3O5 and molecular weight 511.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-bromophenyl)-hydroxymethylidene]-5-(4-hydroxy-3-methoxyphenyl)-1-(3-imidazol-1-ylpropyl)pyrrolidine-2,3-dione
Also Known As: BAS 03321640, 4-(4-bromobenzoyl)-3-hydroxy-5-(4-hydroxy-3-methoxyphenyl)-1-[3-(1H-imidazol-1-yl)propyl]-2,5-dihydro-1H-pyrrol-2-one, 4-[(4-bromophenyl)-hydroxymethylidene]-5-(4-hydroxy-3-methoxyphenyl)-1-(3-imidazol-1-ylpropyl)pyrrolidine-2,3-dione
| Molecular Formula | C24H22BrN3O5 |
|---|---|
| Molecular Weight | 511.07 g/mol |
| LogP | 3.8718 |
| Topological Polar Surface Area | 104.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 511.07428 |
| Heavy Atoms | 33 |
| Complexity | 1205.3474 |
Chemical Identifiers
| CAS Number | 440096-97-9 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C2C(=C(C3=CC=C(C=C3)Br)O)C(=O)C(=O)N2CCCN4C=CN=C4)O |
Product Overview
BAS 03321640 (CAS 440096-97-9), with molecular formula C24H22BrN3O5 and molecular weight 511.07 g/mol. IUPAC: 4-[(4-bromophenyl)-hydroxymethylidene]-5-(4-hydroxy-3-methoxyphenyl)-1-(3-imidazol-1-ylpropyl)pyrrolidine-2,3-dione.
Chemical Property Profile of BAS 03321640
Property Insights of BAS 03321640
The XLogP value of 3.8718 indicates that BAS 03321640 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.89 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03321640. Following Lipinski's Rule of Five, BAS 03321640 has 2 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 BAS 03321640?
The CAS number of BAS 03321640 is 440096-97-9.
What is the molecular formula of BAS 03321640?
The molecular formula of BAS 03321640 is C24H22BrN3O5.
What is the molecular weight of BAS 03321640?
The molecular weight of BAS 03321640 is 511.07 g/mol.
Where can I buy BAS 03321640?
You can request a quote for BAS 03321640 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03321640?
Yes, KEHONG BIO provides custom synthesis services for BAS 03321640 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.