![3-[4-(3-Bromophenyl)-1,3-thiazol-2-yl]-8-methoxy-2H-1-benzopyran-2-one structure](/static/products/5941/5941-68-4.webp)
3-[4-(3-Bromophenyl)-1,3-thiazol-2-yl]-8-methoxy-2H-1-benzopyran-2-one
TL;DR: 3-[4-(3-Bromophenyl)-1,3-thiazol-2-yl]-8-methoxy-2H-1-benzopyran-2-one (CAS 5941-68-4) is a chemical compound with molecular formula C19H12BrNO3S and molecular weight 412.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-8-methoxychromen-2-one
Also Known As: BIM-0038067.P001, 3-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-8-methoxy-2H-chromen-2-one, 3-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-8-methoxychromen-2-one, 3-[4-(3-Bromophenyl)-1,3-thiazol-2-yl]-8-methoxy-2H-1-benzopyran-2-one
| Molecular Formula | C19H12BrNO3S |
|---|---|
| Molecular Weight | 412.97 g/mol |
| LogP | 5.3546 |
| Topological Polar Surface Area | 52.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 412.97214 |
| Heavy Atoms | 25 |
| Complexity | 1132.9297 |
Chemical Identifiers
| CAS Number | 5941-68-4 |
|---|---|
| SMILES | COC1=CC=CC2=C1OC(=O)C(=C2)C3=NC(=CS3)C4=CC(=CC=C4)Br |
Product Overview
3-[4-(3-Bromophenyl)-1,3-thiazol-2-yl]-8-methoxy-2H-1-benzopyran-2-one (CAS 5941-68-4), with molecular formula C19H12BrNO3S and molecular weight 412.97 g/mol. IUPAC: 3-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-8-methoxychromen-2-one.
Chemical Property Profile of 3-[4-(3-Bromophenyl)-1,3-thiazol-2-yl]-8-methoxy-2H-1-benzopyran-2-one
Property Insights of 3-[4-(3-Bromophenyl)-1,3-thiazol-2-yl]-8-methoxy-2H-1-benzopyran-2-one
The XLogP value of 5.3546 indicates that 3-[4-(3-Bromophenyl)-1,3-thiazol-2-yl]-8-methoxy-2H-1-benzopyran-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.33 Ų, 3-[4-(3-Bromophenyl)-1,3-thiazol-2-yl]-8-methoxy-2H-1-benzopyran-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[4-(3-Bromophenyl)-1,3-thiazol-2-yl]-8-methoxy-2H-1-benzopyran-2-one has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[4-(3-Bromophenyl)-1,3-thiazol-2-yl]-8-methoxy-2H-1-benzopyran-2-one?
The CAS number of 3-[4-(3-Bromophenyl)-1,3-thiazol-2-yl]-8-methoxy-2H-1-benzopyran-2-one is 5941-68-4.
What is the molecular formula of 3-[4-(3-Bromophenyl)-1,3-thiazol-2-yl]-8-methoxy-2H-1-benzopyran-2-one?
The molecular formula of 3-[4-(3-Bromophenyl)-1,3-thiazol-2-yl]-8-methoxy-2H-1-benzopyran-2-one is C19H12BrNO3S.
What is the molecular weight of 3-[4-(3-Bromophenyl)-1,3-thiazol-2-yl]-8-methoxy-2H-1-benzopyran-2-one?
The molecular weight of 3-[4-(3-Bromophenyl)-1,3-thiazol-2-yl]-8-methoxy-2H-1-benzopyran-2-one is 412.97 g/mol.
Where can I buy 3-[4-(3-Bromophenyl)-1,3-thiazol-2-yl]-8-methoxy-2H-1-benzopyran-2-one?
You can request a quote for 3-[4-(3-Bromophenyl)-1,3-thiazol-2-yl]-8-methoxy-2H-1-benzopyran-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[4-(3-Bromophenyl)-1,3-thiazol-2-yl]-8-methoxy-2H-1-benzopyran-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[4-(3-Bromophenyl)-1,3-thiazol-2-yl]-8-methoxy-2H-1-benzopyran-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.