4-(2-Benzothiazolyl)-N,N-diethylbenzenamine
TL;DR: 4-(2-Benzothiazolyl)-N,N-diethylbenzenamine (CAS 10205-57-9) is a chemical compound with molecular formula C17H18N2S and molecular weight 282.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1,3-benzothiazol-2-yl)-N,N-diethylaniline
Also Known As: 2-(4'-Diethylaminophenyl)benzothiazole, 4-(1,3-benzothiazol-2-yl)-N,N-diethylaniline, 2-(4-Diethylaminophenyl)benzothiazol, 2-(4/'-diethylaminophenyl)benzothiazole, Benzenamine, 4-(2-benzothiazolyl)-N,N-diethyl-
| Molecular Formula | C17H18N2S |
|---|---|
| Molecular Weight | 282.12 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 44.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 282.11908 |
| Heavy Atoms | 20 |
| Complexity | 297.0 |
Chemical Identifiers
| CAS Number | 10205-57-9 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)C2=NC3=CC=CC=C3S2 |
| InChIKey | ADRCREMWPUFGDU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(2-Benzothiazolyl)-N,N-diethylbenzenamine (CAS 10205-57-9), with molecular formula C17H18N2S and molecular weight 282.12 g/mol. IUPAC: 4-(1,3-benzothiazol-2-yl)-N,N-diethylaniline.
Chemical Property Profile of 4-(2-Benzothiazolyl)-N,N-diethylbenzenamine
Property Insights of 4-(2-Benzothiazolyl)-N,N-diethylbenzenamine
The XLogP value of 5.1 indicates that 4-(2-Benzothiazolyl)-N,N-diethylbenzenamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.4 Ų, 4-(2-Benzothiazolyl)-N,N-diethylbenzenamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(2-Benzothiazolyl)-N,N-diethylbenzenamine has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(2-Benzothiazolyl)-N,N-diethylbenzenamine?
The CAS number of 4-(2-Benzothiazolyl)-N,N-diethylbenzenamine is 10205-57-9.
What is the molecular formula of 4-(2-Benzothiazolyl)-N,N-diethylbenzenamine?
The molecular formula of 4-(2-Benzothiazolyl)-N,N-diethylbenzenamine is C17H18N2S.
What is the molecular weight of 4-(2-Benzothiazolyl)-N,N-diethylbenzenamine?
The molecular weight of 4-(2-Benzothiazolyl)-N,N-diethylbenzenamine is 282.12 g/mol.
Where can I buy 4-(2-Benzothiazolyl)-N,N-diethylbenzenamine?
You can request a quote for 4-(2-Benzothiazolyl)-N,N-diethylbenzenamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-Benzothiazolyl)-N,N-diethylbenzenamine?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Benzothiazolyl)-N,N-diethylbenzenamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.