ChemDiv1_002333
TL;DR: ChemDiv1_002333 (CAS 330841-59-3) is a chemical compound with molecular formula C22H15N3O4S and molecular weight 417.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-6,7-dimethyl-2-[[5-(2-nitrophenyl)furan-2-yl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one
Also Known As: ChemDiv1_002333, AB00092748-01, AH-487/11778025, (2Z)-6,7-dimethyl-2-[[5-(2-nitrophenyl)furan-2-yl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one, 2-[(5-{2-nitrophenyl}-2-furyl)methylene]-6,7-dimethyl[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
| Molecular Formula | C22H15N3O4S |
|---|---|
| Molecular Weight | 417.08 g/mol |
| LogP | 4.24194 |
| Topological Polar Surface Area | 90.65 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 417.07834 |
| Heavy Atoms | 30 |
| Complexity | 1575.5104 |
Chemical Identifiers
| CAS Number | 330841-59-3 |
|---|---|
| SMILES | CC1=CC2=C(C=C1C)N3C(=O)/C(=C/C4=CC=C(O4)C5=CC=CC=C5[N+](=O)[O-])/SC3=N2 |
Product Overview
ChemDiv1_002333 (CAS 330841-59-3), with molecular formula C22H15N3O4S and molecular weight 417.08 g/mol. IUPAC: (2Z)-6,7-dimethyl-2-[[5-(2-nitrophenyl)furan-2-yl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one.
Chemical Property Profile of ChemDiv1_002333
Property Insights of ChemDiv1_002333
The XLogP value of 4.24194 indicates that ChemDiv1_002333 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 ChemDiv1_002333. Following Lipinski's Rule of Five, ChemDiv1_002333 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 ChemDiv1_002333?
The CAS number of ChemDiv1_002333 is 330841-59-3.
What is the molecular formula of ChemDiv1_002333?
The molecular formula of ChemDiv1_002333 is C22H15N3O4S.
What is the molecular weight of ChemDiv1_002333?
The molecular weight of ChemDiv1_002333 is 417.08 g/mol.
Where can I buy ChemDiv1_002333?
You can request a quote for ChemDiv1_002333 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_002333?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_002333 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.