(3-Chlorobenzo(b)thien-2-yl)(4-(2-pyrimidinyl)-1-piperazinyl)methanone
TL;DR: (3-Chlorobenzo(b)thien-2-yl)(4-(2-pyrimidinyl)-1-piperazinyl)methanone (CAS 294193-87-6) is a chemical compound with molecular formula C17H15ClN4OS and molecular weight 358.07 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-pyrimidin-2-ylpiperazin-1-yl)methanone
Also Known As: (3-Chlorobenzo[b]thien-2-yl)[4-(2-pyrimidinyl)-1-piperazinyl]methanone, (3-chloro-1-benzothiophen-2-yl)[4-(pyrimidin-2-yl)piperazin-1-yl]methanone, A3765/0159702, (3-chloro-1-benzothiophen-2-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone, (3-Chlorobenzo(b)thien-2-yl)(4-(2-pyrimidinyl)-1-piperazinyl)methanone
| Molecular Formula | C17H15ClN4OS |
|---|---|
| Molecular Weight | 358.07 g/mol |
| LogP | 3.3071 |
| Topological Polar Surface Area | 49.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 358.06552 |
| Heavy Atoms | 24 |
| Complexity | 874.68774 |
Chemical Identifiers
| CAS Number | 294193-87-6 |
|---|---|
| SMILES | C1CN(CCN1C2=NC=CC=N2)C(=O)C3=C(C4=CC=CC=C4S3)Cl |
Product Overview
(3-Chlorobenzo(b)thien-2-yl)(4-(2-pyrimidinyl)-1-piperazinyl)methanone (CAS 294193-87-6), with molecular formula C17H15ClN4OS and molecular weight 358.07 g/mol. IUPAC: (3-chloro-1-benzothiophen-2-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone.
Chemical Property Profile of (3-Chlorobenzo(b)thien-2-yl)(4-(2-pyrimidinyl)-1-piperazinyl)methanone
Property Insights of (3-Chlorobenzo(b)thien-2-yl)(4-(2-pyrimidinyl)-1-piperazinyl)methanone
The XLogP value of 3.3071 indicates that (3-Chlorobenzo(b)thien-2-yl)(4-(2-pyrimidinyl)-1-piperazinyl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.33 Ų, (3-Chlorobenzo(b)thien-2-yl)(4-(2-pyrimidinyl)-1-piperazinyl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3-Chlorobenzo(b)thien-2-yl)(4-(2-pyrimidinyl)-1-piperazinyl)methanone has 0 hydrogen bond donor(s) and 5 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 (3-Chlorobenzo(b)thien-2-yl)(4-(2-pyrimidinyl)-1-piperazinyl)methanone?
The CAS number of (3-Chlorobenzo(b)thien-2-yl)(4-(2-pyrimidinyl)-1-piperazinyl)methanone is 294193-87-6.
What is the molecular formula of (3-Chlorobenzo(b)thien-2-yl)(4-(2-pyrimidinyl)-1-piperazinyl)methanone?
The molecular formula of (3-Chlorobenzo(b)thien-2-yl)(4-(2-pyrimidinyl)-1-piperazinyl)methanone is C17H15ClN4OS.
What is the molecular weight of (3-Chlorobenzo(b)thien-2-yl)(4-(2-pyrimidinyl)-1-piperazinyl)methanone?
The molecular weight of (3-Chlorobenzo(b)thien-2-yl)(4-(2-pyrimidinyl)-1-piperazinyl)methanone is 358.07 g/mol.
Where can I buy (3-Chlorobenzo(b)thien-2-yl)(4-(2-pyrimidinyl)-1-piperazinyl)methanone?
You can request a quote for (3-Chlorobenzo(b)thien-2-yl)(4-(2-pyrimidinyl)-1-piperazinyl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-Chlorobenzo(b)thien-2-yl)(4-(2-pyrimidinyl)-1-piperazinyl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (3-Chlorobenzo(b)thien-2-yl)(4-(2-pyrimidinyl)-1-piperazinyl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.