![2-(1,3-benzothiazol-2-yl)-3H-benzo[f]chromen-3-one structure](/static/products/7054/70546-21-3.webp)
2-(1,3-benzothiazol-2-yl)-3H-benzo[f]chromen-3-one
TL;DR: 2-(1,3-benzothiazol-2-yl)-3H-benzo[f]chromen-3-one (CAS 70546-21-3) is a chemical compound with molecular formula C20H11NO2S and molecular weight 329.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzothiazol-2-yl)benzo[f]chromen-3-one
Also Known As: 2-(1,3-benzothiazol-2-yl)-3H-benzo[f]chromen-3-one, 2-(1,3-benzothiazol-2-yl)benzo[f]chromen-3-one, BAS 01290173, NCI60_036365, 2-benzothiazol-2-ylbenzo[f]chromen-3-one
| Molecular Formula | C20H11NO2S |
|---|---|
| Molecular Weight | 329.05 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 67.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 329.05106 |
| Heavy Atoms | 24 |
| Complexity | 548.0 |
Chemical Identifiers
| CAS Number | 70546-21-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=C2C=C(C(=O)O3)C4=NC5=CC=CC=C5S4 |
| InChIKey | JPPWEIAVDSSHIT-UHFFFAOYSA-N |
Product Overview
2-(1,3-benzothiazol-2-yl)-3H-benzo[f]chromen-3-one (CAS 70546-21-3), with molecular formula C20H11NO2S and molecular weight 329.05 g/mol. IUPAC: 2-(1,3-benzothiazol-2-yl)benzo[f]chromen-3-one.
Chemical Property Profile of 2-(1,3-benzothiazol-2-yl)-3H-benzo[f]chromen-3-one
Property Insights of 2-(1,3-benzothiazol-2-yl)-3H-benzo[f]chromen-3-one
The XLogP value of 5.3 indicates that 2-(1,3-benzothiazol-2-yl)-3H-benzo[f]chromen-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1,3-benzothiazol-2-yl)-3H-benzo[f]chromen-3-one. Following Lipinski's Rule of Five, 2-(1,3-benzothiazol-2-yl)-3H-benzo[f]chromen-3-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(1,3-benzothiazol-2-yl)-3H-benzo[f]chromen-3-one?
The CAS number of 2-(1,3-benzothiazol-2-yl)-3H-benzo[f]chromen-3-one is 70546-21-3.
What is the molecular formula of 2-(1,3-benzothiazol-2-yl)-3H-benzo[f]chromen-3-one?
The molecular formula of 2-(1,3-benzothiazol-2-yl)-3H-benzo[f]chromen-3-one is C20H11NO2S.
What is the molecular weight of 2-(1,3-benzothiazol-2-yl)-3H-benzo[f]chromen-3-one?
The molecular weight of 2-(1,3-benzothiazol-2-yl)-3H-benzo[f]chromen-3-one is 329.05 g/mol.
Where can I buy 2-(1,3-benzothiazol-2-yl)-3H-benzo[f]chromen-3-one?
You can request a quote for 2-(1,3-benzothiazol-2-yl)-3H-benzo[f]chromen-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1,3-benzothiazol-2-yl)-3H-benzo[f]chromen-3-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,3-benzothiazol-2-yl)-3H-benzo[f]chromen-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.