4-(6-Methoxy-1,3-benzothiazol-2-yl)aniline
TL;DR: 4-(6-Methoxy-1,3-benzothiazol-2-yl)aniline (CAS 43036-17-5) is a chemical compound with molecular formula C14H12N2OS and molecular weight 256.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(6-methoxy-1,3-benzothiazol-2-yl)aniline
Also Known As: 6-MEO-BTA-0, 2-(4-Aminophenyl)-6-methoxybenzothiazole, 4-(6-methoxy-1,3-benzothiazol-2-yl)aniline, 4-(6-Methoxybenzo[d]thiazol-2-yl)aniline, 2-(4'-Aminophenyl)-6-methoxybenzothiazole
| Molecular Formula | C14H12N2OS |
|---|---|
| Molecular Weight | 256.07 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 76.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 256.06705 |
| Heavy Atoms | 18 |
| Complexity | 281.0 |
Chemical Identifiers
| CAS Number | 43036-17-5 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N |
| InChIKey | KLRFVKNLVPQVIN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(6-Methoxy-1,3-benzothiazol-2-yl)aniline (CAS 43036-17-5), with molecular formula C14H12N2OS and molecular weight 256.07 g/mol. IUPAC: 4-(6-methoxy-1,3-benzothiazol-2-yl)aniline.
Chemical Property Profile of 4-(6-Methoxy-1,3-benzothiazol-2-yl)aniline
Property Insights of 4-(6-Methoxy-1,3-benzothiazol-2-yl)aniline
The XLogP value of 3.6 indicates that 4-(6-Methoxy-1,3-benzothiazol-2-yl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(6-Methoxy-1,3-benzothiazol-2-yl)aniline. Following Lipinski's Rule of Five, 4-(6-Methoxy-1,3-benzothiazol-2-yl)aniline has 1 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 4-(6-Methoxy-1,3-benzothiazol-2-yl)aniline?
The CAS number of 4-(6-Methoxy-1,3-benzothiazol-2-yl)aniline is 43036-17-5.
What is the molecular formula of 4-(6-Methoxy-1,3-benzothiazol-2-yl)aniline?
The molecular formula of 4-(6-Methoxy-1,3-benzothiazol-2-yl)aniline is C14H12N2OS.
What is the molecular weight of 4-(6-Methoxy-1,3-benzothiazol-2-yl)aniline?
The molecular weight of 4-(6-Methoxy-1,3-benzothiazol-2-yl)aniline is 256.07 g/mol.
Where can I buy 4-(6-Methoxy-1,3-benzothiazol-2-yl)aniline?
You can request a quote for 4-(6-Methoxy-1,3-benzothiazol-2-yl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(6-Methoxy-1,3-benzothiazol-2-yl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 4-(6-Methoxy-1,3-benzothiazol-2-yl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.