BAS 00886322
TL;DR: BAS 00886322 (CAS 330845-46-0) is a chemical compound with molecular formula C22H14Cl2N2O4 and molecular weight 440.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-[[5-(2,5-dichlorophenyl)furan-2-yl]methylidene]-1-(4-methylphenyl)-1,3-diazinane-2,4,6-trione
Also Known As: BAS 00886322, A2190/0092112, (5E)-5-{[5-(2,5-dichlorophenyl)furan-2-yl]methylidene}-1-(4-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione, (5E)-5-[[5-(2,5-dichlorophenyl)furan-2-yl]methylidene]-1-(4-methylphenyl)-1,3-diazinane-2,4,6-trione, (5E)-5-{[5-(2,5-DICHLOROPHENYL)FURAN-2-YL]METHYLIDENE}-1-(4-METHYLPHENYL)-1,3-DIAZINANE-2,4,6-TRIONE
| Molecular Formula | C22H14Cl2N2O4 |
|---|---|
| Molecular Weight | 440.03 g/mol |
| LogP | 5.22822 |
| Topological Polar Surface Area | 79.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 440.03305 |
| Heavy Atoms | 30 |
| Complexity | 1212.1304 |
Chemical Identifiers
| CAS Number | 330845-46-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=O)/C(=C/C3=CC=C(O3)C4=C(C=CC(=C4)Cl)Cl)/C(=O)NC2=O |
Product Overview
BAS 00886322 (CAS 330845-46-0), with molecular formula C22H14Cl2N2O4 and molecular weight 440.03 g/mol. IUPAC: (5E)-5-[[5-(2,5-dichlorophenyl)furan-2-yl]methylidene]-1-(4-methylphenyl)-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of BAS 00886322
Property Insights of BAS 00886322
The XLogP value of 5.22822 indicates that BAS 00886322 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.62 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00886322. Following Lipinski's Rule of Five, BAS 00886322 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00886322?
The CAS number of BAS 00886322 is 330845-46-0.
What is the molecular formula of BAS 00886322?
The molecular formula of BAS 00886322 is C22H14Cl2N2O4.
What is the molecular weight of BAS 00886322?
The molecular weight of BAS 00886322 is 440.03 g/mol.
Where can I buy BAS 00886322?
You can request a quote for BAS 00886322 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00886322?
Yes, KEHONG BIO provides custom synthesis services for BAS 00886322 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.