N-(5-methylheptyl)-1,3-benzothiazol-2-amine
TL;DR: N-(5-methylheptyl)-1,3-benzothiazol-2-amine (CAS 379729-46-1) is a chemical compound with molecular formula C15H22N2S and molecular weight 262.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-methylheptyl)-1,3-benzothiazol-2-amine
Also Known As: N-(5-methylheptyl)-1,3-benzothiazol-2-amine, Benzothiazol-2-yl-(5-methyl-heptyl)-amine, benzothiazol-2-yl-(5-methyl-heptyl)amine, n-(5-Methylheptyl)benzo[d]thiazol-2-amine
| Molecular Formula | C15H22N2S |
|---|---|
| Molecular Weight | 262.15 g/mol |
| LogP | 4.9246 |
| Topological Polar Surface Area | 24.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 262.15036 |
| Heavy Atoms | 18 |
| Complexity | 445.05325 |
Chemical Identifiers
| CAS Number | 379729-46-1 |
|---|---|
| SMILES | CCC(C)CCCCNC1=NC2=CC=CC=C2S1 |
Product Overview
N-(5-methylheptyl)-1,3-benzothiazol-2-amine (CAS 379729-46-1), with molecular formula C15H22N2S and molecular weight 262.15 g/mol. IUPAC: N-(5-methylheptyl)-1,3-benzothiazol-2-amine.
Chemical Property Profile of N-(5-methylheptyl)-1,3-benzothiazol-2-amine
Property Insights of N-(5-methylheptyl)-1,3-benzothiazol-2-amine
The XLogP value of 4.9246 indicates that N-(5-methylheptyl)-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 24.92 Ų, N-(5-methylheptyl)-1,3-benzothiazol-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(5-methylheptyl)-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-(5-methylheptyl)-1,3-benzothiazol-2-amine?
The CAS number of N-(5-methylheptyl)-1,3-benzothiazol-2-amine is 379729-46-1.
What is the molecular formula of N-(5-methylheptyl)-1,3-benzothiazol-2-amine?
The molecular formula of N-(5-methylheptyl)-1,3-benzothiazol-2-amine is C15H22N2S.
What is the molecular weight of N-(5-methylheptyl)-1,3-benzothiazol-2-amine?
The molecular weight of N-(5-methylheptyl)-1,3-benzothiazol-2-amine is 262.15 g/mol.
Where can I buy N-(5-methylheptyl)-1,3-benzothiazol-2-amine?
You can request a quote for N-(5-methylheptyl)-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-(5-methylheptyl)-1,3-benzothiazol-2-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(5-methylheptyl)-1,3-benzothiazol-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.