4-(Piperidin-1-ylsulfonyl)benzoyl chloride
TL;DR: 4-(Piperidin-1-ylsulfonyl)benzoyl chloride (CAS 29171-75-3) is a chemical compound with molecular formula C12H14ClNO3S and molecular weight 287.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-piperidin-1-ylsulfonylbenzoyl chloride
Also Known As: 4-(Piperidin-1-ylsulfonyl)benzoyl chloride, 4-(piperidine-1-sulfonyl)benzoyl chloride, 4-piperidin-1-ylsulfonylbenzoyl chloride, 4-(piperidine-1-sulfonyl)benzoylchloride, 4-(piperidylsulfonyl)benzoyl chloride
| Molecular Formula | C12H14ClNO3S |
|---|---|
| Molecular Weight | 287.04 g/mol |
| LogP | 2.2402 |
| Topological Polar Surface Area | 54.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 287.0383 |
| Heavy Atoms | 18 |
| Complexity | 532.94586 |
Chemical Identifiers
| CAS Number | 29171-75-3 |
|---|---|
| SMILES | C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)Cl |
Product Overview
4-(Piperidin-1-ylsulfonyl)benzoyl chloride (CAS 29171-75-3), with molecular formula C12H14ClNO3S and molecular weight 287.04 g/mol. IUPAC: 4-piperidin-1-ylsulfonylbenzoyl chloride.
Chemical Property Profile of 4-(Piperidin-1-ylsulfonyl)benzoyl chloride
Property Insights of 4-(Piperidin-1-ylsulfonyl)benzoyl chloride
The XLogP value of 2.2402 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Piperidin-1-ylsulfonyl)benzoyl chloride. With a topological polar surface area (TPSA) of 54.45 Ų, 4-(Piperidin-1-ylsulfonyl)benzoyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Piperidin-1-ylsulfonyl)benzoyl chloride 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 4-(Piperidin-1-ylsulfonyl)benzoyl chloride?
The CAS number of 4-(Piperidin-1-ylsulfonyl)benzoyl chloride is 29171-75-3.
What is the molecular formula of 4-(Piperidin-1-ylsulfonyl)benzoyl chloride?
The molecular formula of 4-(Piperidin-1-ylsulfonyl)benzoyl chloride is C12H14ClNO3S.
What is the molecular weight of 4-(Piperidin-1-ylsulfonyl)benzoyl chloride?
The molecular weight of 4-(Piperidin-1-ylsulfonyl)benzoyl chloride is 287.04 g/mol.
Where can I buy 4-(Piperidin-1-ylsulfonyl)benzoyl chloride?
You can request a quote for 4-(Piperidin-1-ylsulfonyl)benzoyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Piperidin-1-ylsulfonyl)benzoyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 4-(Piperidin-1-ylsulfonyl)benzoyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.