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Naphtho[1,2-d]thiazole, 2-methyl-
TL;DR: Naphtho[1,2-d]thiazole, 2-methyl- (CAS 2682-45-3) is a chemical compound with molecular formula C12H9NS and molecular weight 199.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylbenzo[e][1,3]benzothiazole
Also Known As: 2-Methylnaphtho[1,2-d]thiazole, 2-Methyl-beta-naphthothiazole, 2-Methylnaphtho(1,2-d)thiazole, aurora ka-80, 2-Methylnaphtho[1,2-d][1,3]thiazole
| Molecular Formula | C12H9NS |
|---|---|
| Molecular Weight | 199.05 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 199.04558 |
| Heavy Atoms | 14 |
| Complexity | 218.0 |
Chemical Identifiers
| CAS Number | 2682-45-3 |
|---|---|
| SMILES | CC1=NC2=C(S1)C=CC3=CC=CC=C32 |
| InChIKey | OUXMJRMYZCEVKO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Naphtho[1,2-d]thiazole, 2-methyl- (CAS 2682-45-3), with molecular formula C12H9NS and molecular weight 199.05 g/mol. IUPAC: 2-methylbenzo[e][1,3]benzothiazole.
Chemical Property Profile of Naphtho[1,2-d]thiazole, 2-methyl-
Property Insights of Naphtho[1,2-d]thiazole, 2-methyl-
The XLogP value of 4.0 indicates that Naphtho[1,2-d]thiazole, 2-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.1 Ų, Naphtho[1,2-d]thiazole, 2-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Naphtho[1,2-d]thiazole, 2-methyl- has 0 hydrogen bond donor(s) and 2 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 Naphtho[1,2-d]thiazole, 2-methyl-?
The CAS number of Naphtho[1,2-d]thiazole, 2-methyl- is 2682-45-3.
What is the molecular formula of Naphtho[1,2-d]thiazole, 2-methyl-?
The molecular formula of Naphtho[1,2-d]thiazole, 2-methyl- is C12H9NS.
What is the molecular weight of Naphtho[1,2-d]thiazole, 2-methyl-?
The molecular weight of Naphtho[1,2-d]thiazole, 2-methyl- is 199.05 g/mol.
Where can I buy Naphtho[1,2-d]thiazole, 2-methyl-?
You can request a quote for Naphtho[1,2-d]thiazole, 2-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Naphtho[1,2-d]thiazole, 2-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Naphtho[1,2-d]thiazole, 2-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.