BAS 01089235
TL;DR: BAS 01089235 (CAS 292640-39-2) is a chemical compound with molecular formula C21H12ClN3O5S and molecular weight 453.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-[[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene]-1-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: BAS 01089235, (5E)-5-[[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene]-1-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione, (5E)-5-{[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene}-1-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione, (E)-5-((5-(2-chloro-5-nitrophenyl)furan-2-yl)methylene)-1-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione, (5E)-5-{[5-(2-CHLORO-5-NITROPHENYL)FURAN-2-YL]METHYLIDENE}-1-PHENYL-2-SULFANYLIDENE-1,3-DIAZINANE-4,6-DIONE
| Molecular Formula | C21H12ClN3O5S |
|---|---|
| Molecular Weight | 453.02 g/mol |
| LogP | 4.3395 |
| Topological Polar Surface Area | 105.69 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 453.01862 |
| Heavy Atoms | 31 |
| Complexity | 1269.0294 |
Chemical Identifiers
| CAS Number | 292640-39-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=O)/C(=C/C3=CC=C(O3)C4=C(C=CC(=C4)[N+](=O)[O-])Cl)/C(=O)NC2=S |
Product Overview
BAS 01089235 (CAS 292640-39-2), with molecular formula C21H12ClN3O5S and molecular weight 453.02 g/mol. IUPAC: (5E)-5-[[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene]-1-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione.
Chemical Property Profile of BAS 01089235
Property Insights of BAS 01089235
The XLogP value of 4.3395 indicates that BAS 01089235 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.69 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01089235. Following Lipinski's Rule of Five, BAS 01089235 has 1 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 01089235?
The CAS number of BAS 01089235 is 292640-39-2.
What is the molecular formula of BAS 01089235?
The molecular formula of BAS 01089235 is C21H12ClN3O5S.
What is the molecular weight of BAS 01089235?
The molecular weight of BAS 01089235 is 453.02 g/mol.
Where can I buy BAS 01089235?
You can request a quote for BAS 01089235 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01089235?
Yes, KEHONG BIO provides custom synthesis services for BAS 01089235 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.