Benzothiazole, 2,2'-methylenebis-
TL;DR: Benzothiazole, 2,2'-methylenebis- (CAS 1945-78-4) is a chemical compound with molecular formula C15H10N2S2 and molecular weight 282.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzothiazol-2-ylmethyl)-1,3-benzothiazole
Also Known As: 2,2'-Methylenebisbenzothiazole, Bis(benzo[d]thiazol-2-yl)methane, Benzothiazole, 2,2'-methylenebis-, Dotinurad Impurity 55, Di-2-benzothiazolylmethane
| Molecular Formula | C15H10N2S2 |
|---|---|
| Molecular Weight | 282.03 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 82.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 282.02853 |
| Heavy Atoms | 19 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 1945-78-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)CC3=NC4=CC=CC=C4S3 |
| InChIKey | ZRXNLCFJIKBZCA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzothiazole, 2,2'-methylenebis- (CAS 1945-78-4), with molecular formula C15H10N2S2 and molecular weight 282.03 g/mol. IUPAC: 2-(1,3-benzothiazol-2-ylmethyl)-1,3-benzothiazole.
Chemical Property Profile of Benzothiazole, 2,2'-methylenebis-
Property Insights of Benzothiazole, 2,2'-methylenebis-
The XLogP value of 4.8 indicates that Benzothiazole, 2,2'-methylenebis- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzothiazole, 2,2'-methylenebis-. Following Lipinski's Rule of Five, Benzothiazole, 2,2'-methylenebis- has 0 hydrogen bond donor(s) and 4 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 Benzothiazole, 2,2'-methylenebis-?
The CAS number of Benzothiazole, 2,2'-methylenebis- is 1945-78-4.
What is the molecular formula of Benzothiazole, 2,2'-methylenebis-?
The molecular formula of Benzothiazole, 2,2'-methylenebis- is C15H10N2S2.
What is the molecular weight of Benzothiazole, 2,2'-methylenebis-?
The molecular weight of Benzothiazole, 2,2'-methylenebis- is 282.03 g/mol.
Where can I buy Benzothiazole, 2,2'-methylenebis-?
You can request a quote for Benzothiazole, 2,2'-methylenebis- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzothiazole, 2,2'-methylenebis-?
Yes, KEHONG BIO provides custom synthesis services for Benzothiazole, 2,2'-methylenebis- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.