3-(benzo[d]thiazol-2-yl)-2-oxo-2H-chromen-7-yl 4-fluorobenzoate
TL;DR: 3-(benzo[d]thiazol-2-yl)-2-oxo-2H-chromen-7-yl 4-fluorobenzoate (CAS 384367-84-4) is a chemical compound with molecular formula C23H12FNO4S and molecular weight 417.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(1,3-benzothiazol-2-yl)-2-oxochromen-7-yl] 4-fluorobenzoate
Also Known As: UPCMLD0ENAT0511-1290:001, (3-benzothiazol-2-yl-2-oxo-chromen-7-yl) 4-fluorobenzoate, 3-(benzo[d]thiazol-2-yl)-2-oxo-2H-chromen-7-yl 4-fluorobenzoate, [3-(1,3-benzothiazol-2-yl)-2-oxochromen-7-yl] 4-fluorobenzoate, 3-(1,3-benzothiazol-2-yl)-2-oxo-2H-chromen-7-yl 4-fluorobenzoate
| Molecular Formula | C23H12FNO4S |
|---|---|
| Molecular Weight | 417.05 g/mol |
| LogP | 5.428 |
| Topological Polar Surface Area | 69.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 417.04712 |
| Heavy Atoms | 30 |
| Complexity | 1437.6503 |
Chemical Identifiers
| CAS Number | 384367-84-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)C3=CC4=C(C=C(C=C4)OC(=O)C5=CC=C(C=C5)F)OC3=O |
Product Overview
3-(benzo[d]thiazol-2-yl)-2-oxo-2H-chromen-7-yl 4-fluorobenzoate (CAS 384367-84-4), with molecular formula C23H12FNO4S and molecular weight 417.05 g/mol. IUPAC: [3-(1,3-benzothiazol-2-yl)-2-oxochromen-7-yl] 4-fluorobenzoate.
Chemical Property Profile of 3-(benzo[d]thiazol-2-yl)-2-oxo-2H-chromen-7-yl 4-fluorobenzoate
Property Insights of 3-(benzo[d]thiazol-2-yl)-2-oxo-2H-chromen-7-yl 4-fluorobenzoate
The XLogP value of 5.428 indicates that 3-(benzo[d]thiazol-2-yl)-2-oxo-2H-chromen-7-yl 4-fluorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(benzo[d]thiazol-2-yl)-2-oxo-2H-chromen-7-yl 4-fluorobenzoate. Following Lipinski's Rule of Five, 3-(benzo[d]thiazol-2-yl)-2-oxo-2H-chromen-7-yl 4-fluorobenzoate has 0 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 3-(benzo[d]thiazol-2-yl)-2-oxo-2H-chromen-7-yl 4-fluorobenzoate?
The CAS number of 3-(benzo[d]thiazol-2-yl)-2-oxo-2H-chromen-7-yl 4-fluorobenzoate is 384367-84-4.
What is the molecular formula of 3-(benzo[d]thiazol-2-yl)-2-oxo-2H-chromen-7-yl 4-fluorobenzoate?
The molecular formula of 3-(benzo[d]thiazol-2-yl)-2-oxo-2H-chromen-7-yl 4-fluorobenzoate is C23H12FNO4S.
What is the molecular weight of 3-(benzo[d]thiazol-2-yl)-2-oxo-2H-chromen-7-yl 4-fluorobenzoate?
The molecular weight of 3-(benzo[d]thiazol-2-yl)-2-oxo-2H-chromen-7-yl 4-fluorobenzoate is 417.05 g/mol.
Where can I buy 3-(benzo[d]thiazol-2-yl)-2-oxo-2H-chromen-7-yl 4-fluorobenzoate?
You can request a quote for 3-(benzo[d]thiazol-2-yl)-2-oxo-2H-chromen-7-yl 4-fluorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(benzo[d]thiazol-2-yl)-2-oxo-2H-chromen-7-yl 4-fluorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 3-(benzo[d]thiazol-2-yl)-2-oxo-2H-chromen-7-yl 4-fluorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.