n-Propyl-2,1-benzothiazol-3-amine
TL;DR: n-Propyl-2,1-benzothiazol-3-amine (CAS 6220-46-8) is a chemical compound with molecular formula C10H12N2S and molecular weight 192.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-propyl-2,1-benzothiazol-3-amine
Also Known As: n-propyl-2,1-benzothiazol-3-amine, 3-(Propylamino)-2,1-benzisothiazole, n-Propyl-2,1-benzisothiazol-3-amine, 2,1-Benzisothiazol-3-amine, N-propyl-, 3-(n-Propylamino)-2,1-benzisothiazole
| Molecular Formula | C10H12N2S |
|---|---|
| Molecular Weight | 192.07 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 53.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 192.07211 |
| Heavy Atoms | 13 |
| Complexity | 163.0 |
Chemical Identifiers
| CAS Number | 6220-46-8 |
|---|---|
| SMILES | CCCNC1=C2C=CC=CC2=NS1 |
| InChIKey | JMSNWWKHZFQDKG-UHFFFAOYSA-N |
Product Overview
n-Propyl-2,1-benzothiazol-3-amine (CAS 6220-46-8), with molecular formula C10H12N2S and molecular weight 192.07 g/mol. IUPAC: N-propyl-2,1-benzothiazol-3-amine.
Chemical Property Profile of n-Propyl-2,1-benzothiazol-3-amine
Property Insights of n-Propyl-2,1-benzothiazol-3-amine
The XLogP value of 3.5 indicates that n-Propyl-2,1-benzothiazol-3-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-Propyl-2,1-benzothiazol-3-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, n-Propyl-2,1-benzothiazol-3-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-Propyl-2,1-benzothiazol-3-amine?
The CAS number of n-Propyl-2,1-benzothiazol-3-amine is 6220-46-8.
What is the molecular formula of n-Propyl-2,1-benzothiazol-3-amine?
The molecular formula of n-Propyl-2,1-benzothiazol-3-amine is C10H12N2S.
What is the molecular weight of n-Propyl-2,1-benzothiazol-3-amine?
The molecular weight of n-Propyl-2,1-benzothiazol-3-amine is 192.07 g/mol.
Where can I buy n-Propyl-2,1-benzothiazol-3-amine?
You can request a quote for n-Propyl-2,1-benzothiazol-3-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n-Propyl-2,1-benzothiazol-3-amine?
Yes, KEHONG BIO provides custom synthesis services for n-Propyl-2,1-benzothiazol-3-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.