BAS 00316611
TL;DR: BAS 00316611 (CAS 311327-84-1) is a chemical compound with molecular formula C20H10ClN3O4S and molecular weight 423.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-2-[[5-(2-chloro-4-nitrophenyl)furan-2-yl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one
Also Known As: BAS 00316611, AB00083400-01, 2-{[5-(2-chloro-4-nitrophenyl)-2-furyl]methylene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one, A1299/0059051, (2Z)-2-[[5-(2-chloro-4-nitrophenyl)furan-2-yl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one
| Molecular Formula | C20H10ClN3O4S |
|---|---|
| Molecular Weight | 423.01 g/mol |
| LogP | 4.2785 |
| Topological Polar Surface Area | 90.65 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 423.00806 |
| Heavy Atoms | 29 |
| Complexity | 1532.6847 |
Chemical Identifiers
| CAS Number | 311327-84-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C3N2C(=O)/C(=C/C4=CC=C(O4)C5=C(C=C(C=C5)[N+](=O)[O-])Cl)/S3 |
Product Overview
BAS 00316611 (CAS 311327-84-1), with molecular formula C20H10ClN3O4S and molecular weight 423.01 g/mol. IUPAC: (2Z)-2-[[5-(2-chloro-4-nitrophenyl)furan-2-yl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one.
Chemical Property Profile of BAS 00316611
Property Insights of BAS 00316611
The XLogP value of 4.2785 indicates that BAS 00316611 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.65 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00316611. Following Lipinski's Rule of Five, BAS 00316611 has 0 hydrogen bond donor(s) and 6 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 BAS 00316611?
The CAS number of BAS 00316611 is 311327-84-1.
What is the molecular formula of BAS 00316611?
The molecular formula of BAS 00316611 is C20H10ClN3O4S.
What is the molecular weight of BAS 00316611?
The molecular weight of BAS 00316611 is 423.01 g/mol.
Where can I buy BAS 00316611?
You can request a quote for BAS 00316611 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00316611?
Yes, KEHONG BIO provides custom synthesis services for BAS 00316611 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.