4-(3-Butyl-ureido)-2-methyl-benzenesulfonylchloride
TL;DR: 4-(3-Butyl-ureido)-2-methyl-benzenesulfonylchloride (CAS 678185-73-4) is a chemical compound with molecular formula C12H17ClN2O3S and molecular weight 304.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(butylcarbamoylamino)-2-methylbenzenesulfonyl chloride
Also Known As: 4-(3-butylureido)-2-methylbenzenesulfonylchloride, 4-(3-Butyl-ureido)-2-methyl-benzenesulfonyl chloride, 4-(3-Butylureido)-2-methylbenzene-1-sulfonyl chloride, 4-(butylcarbamoylamino)-2-methylbenzenesulfonyl chloride, 4-(3-butyl-ureido)-2-methyl-benzenesulfonylchloride
| Molecular Formula | C12H17ClN2O3S |
|---|---|
| Molecular Weight | 304.06 g/mol |
| LogP | 2.84412 |
| Topological Polar Surface Area | 75.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 304.06485 |
| Heavy Atoms | 19 |
| Complexity | 558.09296 |
Chemical Identifiers
| CAS Number | 678185-73-4 |
|---|---|
| SMILES | CCCCNC(=O)NC1=CC(=C(C=C1)S(=O)(=O)Cl)C |
Product Overview
4-(3-Butyl-ureido)-2-methyl-benzenesulfonylchloride (CAS 678185-73-4), with molecular formula C12H17ClN2O3S and molecular weight 304.06 g/mol. IUPAC: 4-(butylcarbamoylamino)-2-methylbenzenesulfonyl chloride.
Chemical Property Profile of 4-(3-Butyl-ureido)-2-methyl-benzenesulfonylchloride
Property Insights of 4-(3-Butyl-ureido)-2-methyl-benzenesulfonylchloride
The XLogP value of 2.84412 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(3-Butyl-ureido)-2-methyl-benzenesulfonylchloride. The TPSA of 75.27 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(3-Butyl-ureido)-2-methyl-benzenesulfonylchloride. Following Lipinski's Rule of Five, 4-(3-Butyl-ureido)-2-methyl-benzenesulfonylchloride has 2 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-(3-Butyl-ureido)-2-methyl-benzenesulfonylchloride?
The CAS number of 4-(3-Butyl-ureido)-2-methyl-benzenesulfonylchloride is 678185-73-4.
What is the molecular formula of 4-(3-Butyl-ureido)-2-methyl-benzenesulfonylchloride?
The molecular formula of 4-(3-Butyl-ureido)-2-methyl-benzenesulfonylchloride is C12H17ClN2O3S.
What is the molecular weight of 4-(3-Butyl-ureido)-2-methyl-benzenesulfonylchloride?
The molecular weight of 4-(3-Butyl-ureido)-2-methyl-benzenesulfonylchloride is 304.06 g/mol.
Where can I buy 4-(3-Butyl-ureido)-2-methyl-benzenesulfonylchloride?
You can request a quote for 4-(3-Butyl-ureido)-2-methyl-benzenesulfonylchloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(3-Butyl-ureido)-2-methyl-benzenesulfonylchloride?
Yes, KEHONG BIO provides custom synthesis services for 4-(3-Butyl-ureido)-2-methyl-benzenesulfonylchloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.