(3-chloro-1-benzothiophen-2-yl)(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methanone
TL;DR: (3-chloro-1-benzothiophen-2-yl)(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methanone (CAS 354577-15-4) is a chemical compound with molecular formula C14H10Cl2N2OS and molecular weight 323.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-chloro-1-benzothiophen-2-yl)-(4-chloro-3,5-dimethylpyrazol-1-yl)methanone
Also Known As: BAS 02052908, (3-chloro-1-benzothiophen-2-yl)(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methanone, 3-chlorobenzo[b]thiophen-2-yl 4-chloro-3,5-dimethylpyrazolyl ketone, (3-chloro-1-benzothiophen-2-yl)-(4-chloro-3,5-dimethylpyrazol-1-yl)methanone, (3-Chloro-benzo[b]thiophen-2-yl)-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-methanone
| Molecular Formula | C14H10Cl2N2OS |
|---|---|
| Molecular Weight | 323.99 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 63.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 323.98907 |
| Heavy Atoms | 20 |
| Complexity | 397.0 |
Chemical Identifiers
| CAS Number | 354577-15-4 |
|---|---|
| SMILES | CC1=C(C(=NN1C(=O)C2=C(C3=CC=CC=C3S2)Cl)C)Cl |
| InChIKey | GJEPFMZLVSAUHD-UHFFFAOYSA-N |
Product Overview
(3-chloro-1-benzothiophen-2-yl)(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methanone (CAS 354577-15-4), with molecular formula C14H10Cl2N2OS and molecular weight 323.99 g/mol. IUPAC: (3-chloro-1-benzothiophen-2-yl)-(4-chloro-3,5-dimethylpyrazol-1-yl)methanone.
Chemical Property Profile of (3-chloro-1-benzothiophen-2-yl)(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methanone
Property Insights of (3-chloro-1-benzothiophen-2-yl)(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methanone
The XLogP value of 5.2 indicates that (3-chloro-1-benzothiophen-2-yl)(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.1 Ų falls within the moderate polarity range, balancing permeability and solubility for (3-chloro-1-benzothiophen-2-yl)(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methanone. Following Lipinski's Rule of Five, (3-chloro-1-benzothiophen-2-yl)(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methanone has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (3-chloro-1-benzothiophen-2-yl)(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methanone?
The CAS number of (3-chloro-1-benzothiophen-2-yl)(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methanone is 354577-15-4.
What is the molecular formula of (3-chloro-1-benzothiophen-2-yl)(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methanone?
The molecular formula of (3-chloro-1-benzothiophen-2-yl)(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methanone is C14H10Cl2N2OS.
What is the molecular weight of (3-chloro-1-benzothiophen-2-yl)(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methanone?
The molecular weight of (3-chloro-1-benzothiophen-2-yl)(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methanone is 323.99 g/mol.
Where can I buy (3-chloro-1-benzothiophen-2-yl)(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methanone?
You can request a quote for (3-chloro-1-benzothiophen-2-yl)(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-chloro-1-benzothiophen-2-yl)(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (3-chloro-1-benzothiophen-2-yl)(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.