N,N-Bis(2-benzothiazolylmethyl)-2-benzothiazolemethanamine
TL;DR: N,N-Bis(2-benzothiazolylmethyl)-2-benzothiazolemethanamine (CAS 75472-28-5) is a chemical compound with molecular formula C24H18N4S3 and molecular weight 458.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,3-benzothiazol-2-yl)-N,N-bis(1,3-benzothiazol-2-ylmethyl)methanamine
Also Known As: Trifluormethylarsenic tetramer, Tris(benzothiazol-2-ylmethyl)amine, 1,3-Benzothiazol-2-yl-N,N-bis(1,3-benzothiazol-2-ylmethyl)methanamine, Tris(Benzo[d]thiazol-2-ylmethyl)amine, tris[(1,3-benzothiazol-2-yl)methyl]amine
| Molecular Formula | C24H18N4S3 |
|---|---|
| Molecular Weight | 458.07 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 127.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 458.06937 |
| Heavy Atoms | 31 |
| Complexity | 529.0 |
Chemical Identifiers
| CAS Number | 75472-28-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)CN(CC3=NC4=CC=CC=C4S3)CC5=NC6=CC=CC=C6S5 |
| InChIKey | RYQOCRNXHKYKNY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N-Bis(2-benzothiazolylmethyl)-2-benzothiazolemethanamine (CAS 75472-28-5), with molecular formula C24H18N4S3 and molecular weight 458.07 g/mol. IUPAC: 1-(1,3-benzothiazol-2-yl)-N,N-bis(1,3-benzothiazol-2-ylmethyl)methanamine.
Chemical Property Profile of N,N-Bis(2-benzothiazolylmethyl)-2-benzothiazolemethanamine
Property Insights of N,N-Bis(2-benzothiazolylmethyl)-2-benzothiazolemethanamine
The XLogP value of 6.2 indicates that N,N-Bis(2-benzothiazolylmethyl)-2-benzothiazolemethanamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-Bis(2-benzothiazolylmethyl)-2-benzothiazolemethanamine. Following Lipinski's Rule of Five, N,N-Bis(2-benzothiazolylmethyl)-2-benzothiazolemethanamine has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N,N-Bis(2-benzothiazolylmethyl)-2-benzothiazolemethanamine?
The CAS number of N,N-Bis(2-benzothiazolylmethyl)-2-benzothiazolemethanamine is 75472-28-5.
What is the molecular formula of N,N-Bis(2-benzothiazolylmethyl)-2-benzothiazolemethanamine?
The molecular formula of N,N-Bis(2-benzothiazolylmethyl)-2-benzothiazolemethanamine is C24H18N4S3.
What is the molecular weight of N,N-Bis(2-benzothiazolylmethyl)-2-benzothiazolemethanamine?
The molecular weight of N,N-Bis(2-benzothiazolylmethyl)-2-benzothiazolemethanamine is 458.07 g/mol.
Where can I buy N,N-Bis(2-benzothiazolylmethyl)-2-benzothiazolemethanamine?
You can request a quote for N,N-Bis(2-benzothiazolylmethyl)-2-benzothiazolemethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-Bis(2-benzothiazolylmethyl)-2-benzothiazolemethanamine?
Yes, KEHONG BIO provides custom synthesis services for N,N-Bis(2-benzothiazolylmethyl)-2-benzothiazolemethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.