![[4-(Benzenesulfonyl)piperazin-1-yl]-pyridin-3-ylmethanone structure](/static/products/3337/333756-28-8.webp)
[4-(Benzenesulfonyl)piperazin-1-yl]-pyridin-3-ylmethanone
TL;DR: [4-(Benzenesulfonyl)piperazin-1-yl]-pyridin-3-ylmethanone (CAS 333756-28-8) is a chemical compound with molecular formula C16H17N3O3S and molecular weight 331.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(benzenesulfonyl)piperazin-1-yl]-pyridin-3-ylmethanone
Also Known As: 4-(phenylsulfonyl)piperazinyl 3-pyridyl ketone, BIM-0046071.P001, [4-(benzenesulfonyl)piperazin-1-yl]-pyridin-3-ylmethanone, [4-(phenylsulfonyl)piperazin-1-yl](pyridin-3-yl)methanone, AT-057/43314027
| Molecular Formula | C16H17N3O3S |
|---|---|
| Molecular Weight | 331.10 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 79.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 331.09906 |
| Heavy Atoms | 23 |
| Complexity | 503.0 |
Chemical Identifiers
| CAS Number | 333756-28-8 |
|---|---|
| SMILES | C1CN(CCN1C(=O)C2=CN=CC=C2)S(=O)(=O)C3=CC=CC=C3 |
| InChIKey | NQERVHWPAYNKBW-UHFFFAOYSA-N |
Product Overview
[4-(Benzenesulfonyl)piperazin-1-yl]-pyridin-3-ylmethanone (CAS 333756-28-8), with molecular formula C16H17N3O3S and molecular weight 331.10 g/mol. IUPAC: [4-(benzenesulfonyl)piperazin-1-yl]-pyridin-3-ylmethanone.
Chemical Property Profile of [4-(Benzenesulfonyl)piperazin-1-yl]-pyridin-3-ylmethanone
Property Insights of [4-(Benzenesulfonyl)piperazin-1-yl]-pyridin-3-ylmethanone
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [4-(Benzenesulfonyl)piperazin-1-yl]-pyridin-3-ylmethanone. The TPSA of 79.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-(Benzenesulfonyl)piperazin-1-yl]-pyridin-3-ylmethanone. Following Lipinski's Rule of Five, [4-(Benzenesulfonyl)piperazin-1-yl]-pyridin-3-ylmethanone 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 [4-(Benzenesulfonyl)piperazin-1-yl]-pyridin-3-ylmethanone?
The CAS number of [4-(Benzenesulfonyl)piperazin-1-yl]-pyridin-3-ylmethanone is 333756-28-8.
What is the molecular formula of [4-(Benzenesulfonyl)piperazin-1-yl]-pyridin-3-ylmethanone?
The molecular formula of [4-(Benzenesulfonyl)piperazin-1-yl]-pyridin-3-ylmethanone is C16H17N3O3S.
What is the molecular weight of [4-(Benzenesulfonyl)piperazin-1-yl]-pyridin-3-ylmethanone?
The molecular weight of [4-(Benzenesulfonyl)piperazin-1-yl]-pyridin-3-ylmethanone is 331.10 g/mol.
Where can I buy [4-(Benzenesulfonyl)piperazin-1-yl]-pyridin-3-ylmethanone?
You can request a quote for [4-(Benzenesulfonyl)piperazin-1-yl]-pyridin-3-ylmethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-(Benzenesulfonyl)piperazin-1-yl]-pyridin-3-ylmethanone?
Yes, KEHONG BIO provides custom synthesis services for [4-(Benzenesulfonyl)piperazin-1-yl]-pyridin-3-ylmethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.