4-chloro-N-(3-methoxypropyl)-2,5-dimethylbenzenesulfonamide
TL;DR: 4-chloro-N-(3-methoxypropyl)-2,5-dimethylbenzenesulfonamide (CAS 853902-86-0) is a chemical compound with molecular formula C12H18ClNO3S and molecular weight 291.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-(3-methoxypropyl)-2,5-dimethylbenzenesulfonamide
Also Known As: 4-chloro-N-(3-methoxypropyl)-2,5-dimethylbenzenesulfonamide, A4126/0175915, [(4-chloro-2,5-dimethylphenyl)sulfonyl](3-methoxypropyl)amine, 4-chloro-N-(3-methoxypropyl)-2,5-dimethylbenzene-1-sulfonamide
| Molecular Formula | C12H18ClNO3S |
|---|---|
| Molecular Weight | 291.07 g/mol |
| LogP | 2.27164 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 291.06958 |
| Heavy Atoms | 18 |
| Complexity | 514.29895 |
Chemical Identifiers
| CAS Number | 853902-86-0 |
|---|---|
| SMILES | CC1=CC(=C(C=C1Cl)C)S(=O)(=O)NCCCOC |
Product Overview
4-chloro-N-(3-methoxypropyl)-2,5-dimethylbenzenesulfonamide (CAS 853902-86-0), with molecular formula C12H18ClNO3S and molecular weight 291.07 g/mol. IUPAC: 4-chloro-N-(3-methoxypropyl)-2,5-dimethylbenzenesulfonamide.
Chemical Property Profile of 4-chloro-N-(3-methoxypropyl)-2,5-dimethylbenzenesulfonamide
Property Insights of 4-chloro-N-(3-methoxypropyl)-2,5-dimethylbenzenesulfonamide
The XLogP value of 2.27164 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-chloro-N-(3-methoxypropyl)-2,5-dimethylbenzenesulfonamide. With a topological polar surface area (TPSA) of 55.4 Ų, 4-chloro-N-(3-methoxypropyl)-2,5-dimethylbenzenesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-chloro-N-(3-methoxypropyl)-2,5-dimethylbenzenesulfonamide has 1 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-chloro-N-(3-methoxypropyl)-2,5-dimethylbenzenesulfonamide?
The CAS number of 4-chloro-N-(3-methoxypropyl)-2,5-dimethylbenzenesulfonamide is 853902-86-0.
What is the molecular formula of 4-chloro-N-(3-methoxypropyl)-2,5-dimethylbenzenesulfonamide?
The molecular formula of 4-chloro-N-(3-methoxypropyl)-2,5-dimethylbenzenesulfonamide is C12H18ClNO3S.
What is the molecular weight of 4-chloro-N-(3-methoxypropyl)-2,5-dimethylbenzenesulfonamide?
The molecular weight of 4-chloro-N-(3-methoxypropyl)-2,5-dimethylbenzenesulfonamide is 291.07 g/mol.
Where can I buy 4-chloro-N-(3-methoxypropyl)-2,5-dimethylbenzenesulfonamide?
You can request a quote for 4-chloro-N-(3-methoxypropyl)-2,5-dimethylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-chloro-N-(3-methoxypropyl)-2,5-dimethylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-N-(3-methoxypropyl)-2,5-dimethylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.