Benzothiazole, 6-chloro-2-(4-ethyl-3,5-dimethyl-1H-pyrazol-1-yl)-
TL;DR: Benzothiazole, 6-chloro-2-(4-ethyl-3,5-dimethyl-1H-pyrazol-1-yl)- (CAS 78364-33-7) is a chemical compound with molecular formula C14H14ClN3S and molecular weight 291.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-2-(4-ethyl-3,5-dimethylpyrazol-1-yl)-1,3-benzothiazole
Also Known As: Benzothiazole, 6-chloro-2-(4-ethyl-3,5-dimethyl-1H-pyrazol-1-yl)-, 6-Chloro-2-(4-ethyl-3,5-dimethyl-1H-pyrazol-1-yl)benzothiazole, 6-chloro-2-(4-ethyl-3,5-dimethylpyrazol-1-yl)-1,3-benzothiazole, 6-Chloro-2-(4-ethyl-3,5-dimethyl-1H-pyrazol-1-yl)-1,3-benzothiazole, RefChem:328222
| Molecular Formula | C14H14ClN3S |
|---|---|
| Molecular Weight | 291.06 g/mol |
| LogP | 4.31464 |
| Topological Polar Surface Area | 30.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 291.0597 |
| Heavy Atoms | 19 |
| Complexity | 757.47546 |
Chemical Identifiers
| CAS Number | 78364-33-7 |
|---|---|
| SMILES | CCC1=C(N(N=C1C)C2=NC3=C(S2)C=C(C=C3)Cl)C |
Product Overview
Benzothiazole, 6-chloro-2-(4-ethyl-3,5-dimethyl-1H-pyrazol-1-yl)- (CAS 78364-33-7), with molecular formula C14H14ClN3S and molecular weight 291.06 g/mol. IUPAC: 6-chloro-2-(4-ethyl-3,5-dimethylpyrazol-1-yl)-1,3-benzothiazole.
Chemical Property Profile of Benzothiazole, 6-chloro-2-(4-ethyl-3,5-dimethyl-1H-pyrazol-1-yl)-
Property Insights of Benzothiazole, 6-chloro-2-(4-ethyl-3,5-dimethyl-1H-pyrazol-1-yl)-
The XLogP value of 4.31464 indicates that Benzothiazole, 6-chloro-2-(4-ethyl-3,5-dimethyl-1H-pyrazol-1-yl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.71 Ų, Benzothiazole, 6-chloro-2-(4-ethyl-3,5-dimethyl-1H-pyrazol-1-yl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzothiazole, 6-chloro-2-(4-ethyl-3,5-dimethyl-1H-pyrazol-1-yl)- has 0 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 Benzothiazole, 6-chloro-2-(4-ethyl-3,5-dimethyl-1H-pyrazol-1-yl)-?
The CAS number of Benzothiazole, 6-chloro-2-(4-ethyl-3,5-dimethyl-1H-pyrazol-1-yl)- is 78364-33-7.
What is the molecular formula of Benzothiazole, 6-chloro-2-(4-ethyl-3,5-dimethyl-1H-pyrazol-1-yl)-?
The molecular formula of Benzothiazole, 6-chloro-2-(4-ethyl-3,5-dimethyl-1H-pyrazol-1-yl)- is C14H14ClN3S.
What is the molecular weight of Benzothiazole, 6-chloro-2-(4-ethyl-3,5-dimethyl-1H-pyrazol-1-yl)-?
The molecular weight of Benzothiazole, 6-chloro-2-(4-ethyl-3,5-dimethyl-1H-pyrazol-1-yl)- is 291.06 g/mol.
Where can I buy Benzothiazole, 6-chloro-2-(4-ethyl-3,5-dimethyl-1H-pyrazol-1-yl)-?
You can request a quote for Benzothiazole, 6-chloro-2-(4-ethyl-3,5-dimethyl-1H-pyrazol-1-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzothiazole, 6-chloro-2-(4-ethyl-3,5-dimethyl-1H-pyrazol-1-yl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzothiazole, 6-chloro-2-(4-ethyl-3,5-dimethyl-1H-pyrazol-1-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.