N-(Sec-butyl)-1,3-benzothiazol-2-amine
TL;DR: N-(Sec-butyl)-1,3-benzothiazol-2-amine (CAS 28291-73-8) is a chemical compound with molecular formula C11H14N2S and molecular weight 206.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butan-2-yl-1,3-benzothiazol-2-amine
Also Known As: N-(Sec-butyl)-1,3-benzothiazol-2-amine, N-(butan-2-yl)-1,3-benzothiazol-2-amine, Benzothiazole, 2-(sec-butylamino)-, Benzothiazole, 2-(sec-butylamino)- (8CI), 2-(sec-Butylamino)benzothiazole
| Molecular Formula | C11H14N2S |
|---|---|
| Molecular Weight | 206.09 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 53.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 206.08777 |
| Heavy Atoms | 14 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 28291-73-8 |
|---|---|
| SMILES | CCC(C)NC1=NC2=CC=CC=C2S1 |
| InChIKey | NIQUVXGLIIIHKS-UHFFFAOYSA-N |
Product Overview
N-(Sec-butyl)-1,3-benzothiazol-2-amine (CAS 28291-73-8), with molecular formula C11H14N2S and molecular weight 206.09 g/mol. IUPAC: N-butan-2-yl-1,3-benzothiazol-2-amine.
Chemical Property Profile of N-(Sec-butyl)-1,3-benzothiazol-2-amine
Property Insights of N-(Sec-butyl)-1,3-benzothiazol-2-amine
The XLogP value of 3.9 indicates that N-(Sec-butyl)-1,3-benzothiazol-2-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.2 Ų, N-(Sec-butyl)-1,3-benzothiazol-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(Sec-butyl)-1,3-benzothiazol-2-amine has 1 hydrogen bond donor(s) and 3 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 N-(Sec-butyl)-1,3-benzothiazol-2-amine?
The CAS number of N-(Sec-butyl)-1,3-benzothiazol-2-amine is 28291-73-8.
What is the molecular formula of N-(Sec-butyl)-1,3-benzothiazol-2-amine?
The molecular formula of N-(Sec-butyl)-1,3-benzothiazol-2-amine is C11H14N2S.
What is the molecular weight of N-(Sec-butyl)-1,3-benzothiazol-2-amine?
The molecular weight of N-(Sec-butyl)-1,3-benzothiazol-2-amine is 206.09 g/mol.
Where can I buy N-(Sec-butyl)-1,3-benzothiazol-2-amine?
You can request a quote for N-(Sec-butyl)-1,3-benzothiazol-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(Sec-butyl)-1,3-benzothiazol-2-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(Sec-butyl)-1,3-benzothiazol-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.