Benzothiazole, 2-(3-chloropropyl)-
TL;DR: Benzothiazole, 2-(3-chloropropyl)- (CAS 65655-72-3) is a chemical compound with molecular formula C10H10ClNS and molecular weight 211.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-chloropropyl)-1,3-benzothiazole
Also Known As: Benzothiazole, 2-(3-chloropropyl)-, 2-(3-chloropropyl)benzothiazole, 2-(3-chloropropyl)-1,3-benzothiazole, Benzothiazole, 2-(3-chloropropyl)- (9CI)
| Molecular Formula | C10H10ClNS |
|---|---|
| Molecular Weight | 211.02 g/mol |
| LogP | 3.4677 |
| Topological Polar Surface Area | 12.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 211.02225 |
| Heavy Atoms | 13 |
| Complexity | 363.479 |
Chemical Identifiers
| CAS Number | 65655-72-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)CCCCl |
Product Overview
Benzothiazole, 2-(3-chloropropyl)- (CAS 65655-72-3), with molecular formula C10H10ClNS and molecular weight 211.02 g/mol. IUPAC: 2-(3-chloropropyl)-1,3-benzothiazole.
Chemical Property Profile of Benzothiazole, 2-(3-chloropropyl)-
Property Insights of Benzothiazole, 2-(3-chloropropyl)-
The XLogP value of 3.4677 indicates that Benzothiazole, 2-(3-chloropropyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.89 Ų, Benzothiazole, 2-(3-chloropropyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzothiazole, 2-(3-chloropropyl)- has 0 hydrogen bond donor(s) and 2 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 Benzothiazole, 2-(3-chloropropyl)-?
The CAS number of Benzothiazole, 2-(3-chloropropyl)- is 65655-72-3.
What is the molecular formula of Benzothiazole, 2-(3-chloropropyl)-?
The molecular formula of Benzothiazole, 2-(3-chloropropyl)- is C10H10ClNS.
What is the molecular weight of Benzothiazole, 2-(3-chloropropyl)-?
The molecular weight of Benzothiazole, 2-(3-chloropropyl)- is 211.02 g/mol.
Where can I buy Benzothiazole, 2-(3-chloropropyl)-?
You can request a quote for Benzothiazole, 2-(3-chloropropyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzothiazole, 2-(3-chloropropyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzothiazole, 2-(3-chloropropyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.