![(2-chloropyridin-3-yl)-[4-(3,6-dichloro-1-benzothiophene-2-carbonyl)piperazin-1-yl]methanone structure](/static/products/4450/445016-77-3.webp)
(2-chloropyridin-3-yl)-[4-(3,6-dichloro-1-benzothiophene-2-carbonyl)piperazin-1-yl]methanone
TL;DR: (2-chloropyridin-3-yl)-[4-(3,6-dichloro-1-benzothiophene-2-carbonyl)piperazin-1-yl]methanone (CAS 445016-77-3) is a chemical compound with molecular formula C19H14Cl3N3O2S and molecular weight 452.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-chloro-3-pyridinyl)-[4-(3,6-dichloro-1-benzothiophene-2-carbonyl)piperazin-1-yl]methanone
Also Known As: (2-chloropyridin-3-yl)-[4-(3,6-dichloro-1-benzothiophene-2-carbonyl)piperazin-1-yl]methanone, [4-(2-chloropyridine-3-carbonyl)piperazin-1-yl]-(3,6-dichlorobenzothiophen-2-yl)methanone, 1-[(2-chloro-3-pyridinyl)carbonyl]-4-[(3,6-dichloro-1-benzothien-2-yl)carbonyl]piperazine, 3,6-dichlorobenzo[b]thiophen-2-yl 4-[(2-chloro(3-pyridyl))carbonyl]piperazinyl ketone, (2-chloropyridin-3-yl){4-[(3,6-dichloro-1-benzothiophen-2-yl)carbonyl]piperazin-1-yl}methanone
| Molecular Formula | C19H14Cl3N3O2S |
|---|---|
| Molecular Weight | 452.99 g/mol |
| LogP | 4.8547 |
| Topological Polar Surface Area | 53.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 452.98724 |
| Heavy Atoms | 28 |
| Complexity | 1077.4712 |
Chemical Identifiers
| CAS Number | 445016-77-3 |
|---|---|
| SMILES | C1CN(CCN1C(=O)C2=C(N=CC=C2)Cl)C(=O)C3=C(C4=C(S3)C=C(C=C4)Cl)Cl |
Product Overview
(2-chloropyridin-3-yl)-[4-(3,6-dichloro-1-benzothiophene-2-carbonyl)piperazin-1-yl]methanone (CAS 445016-77-3), with molecular formula C19H14Cl3N3O2S and molecular weight 452.99 g/mol. IUPAC: (2-chloro-3-pyridinyl)-[4-(3,6-dichloro-1-benzothiophene-2-carbonyl)piperazin-1-yl]methanone.
Chemical Property Profile of (2-chloropyridin-3-yl)-[4-(3,6-dichloro-1-benzothiophene-2-carbonyl)piperazin-1-yl]methanone
Property Insights of (2-chloropyridin-3-yl)-[4-(3,6-dichloro-1-benzothiophene-2-carbonyl)piperazin-1-yl]methanone
The XLogP value of 4.8547 indicates that (2-chloropyridin-3-yl)-[4-(3,6-dichloro-1-benzothiophene-2-carbonyl)piperazin-1-yl]methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.51 Ų, (2-chloropyridin-3-yl)-[4-(3,6-dichloro-1-benzothiophene-2-carbonyl)piperazin-1-yl]methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-chloropyridin-3-yl)-[4-(3,6-dichloro-1-benzothiophene-2-carbonyl)piperazin-1-yl]methanone has 0 hydrogen bond donor(s) and 4 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 (2-chloropyridin-3-yl)-[4-(3,6-dichloro-1-benzothiophene-2-carbonyl)piperazin-1-yl]methanone?
The CAS number of (2-chloropyridin-3-yl)-[4-(3,6-dichloro-1-benzothiophene-2-carbonyl)piperazin-1-yl]methanone is 445016-77-3.
What is the molecular formula of (2-chloropyridin-3-yl)-[4-(3,6-dichloro-1-benzothiophene-2-carbonyl)piperazin-1-yl]methanone?
The molecular formula of (2-chloropyridin-3-yl)-[4-(3,6-dichloro-1-benzothiophene-2-carbonyl)piperazin-1-yl]methanone is C19H14Cl3N3O2S.
What is the molecular weight of (2-chloropyridin-3-yl)-[4-(3,6-dichloro-1-benzothiophene-2-carbonyl)piperazin-1-yl]methanone?
The molecular weight of (2-chloropyridin-3-yl)-[4-(3,6-dichloro-1-benzothiophene-2-carbonyl)piperazin-1-yl]methanone is 452.99 g/mol.
Where can I buy (2-chloropyridin-3-yl)-[4-(3,6-dichloro-1-benzothiophene-2-carbonyl)piperazin-1-yl]methanone?
You can request a quote for (2-chloropyridin-3-yl)-[4-(3,6-dichloro-1-benzothiophene-2-carbonyl)piperazin-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 (2-chloropyridin-3-yl)-[4-(3,6-dichloro-1-benzothiophene-2-carbonyl)piperazin-1-yl]methanone?
Yes, KEHONG BIO provides custom synthesis services for (2-chloropyridin-3-yl)-[4-(3,6-dichloro-1-benzothiophene-2-carbonyl)piperazin-1-yl]methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.