羟基甲苯磺丁脲
TL;DR: 羟基甲苯磺丁脲 (CAS 5719-85-7) is a chemical compound with molecular formula C12H18N2O4S and molecular weight 286.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
羟基甲苯磺丁脲
1-butyl-3-[4-(hydroxymethyl)phenyl]sulfonylurea
Also Known As: 4-Hydroxytolbutamide, Hydroxytolbutamide, Hydroxy Tolbutamide, hydroxymethyltolbutamide, Methylhydroxytolbutamide
| Molecular Formula | C12H18N2O4S |
|---|---|
| Molecular Weight | 286.10 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 286.09872 |
| Heavy Atoms | 19 |
| Complexity | 370.0 |
Chemical Identifiers
| CAS Number | 5719-85-7 |
|---|---|
| SMILES | CCCCNC(=O)NS(=O)(=O)C1=CC=C(C=C1)CO |
| InChIKey | SJRHYONYKZIRPM-UHFFFAOYSA-N |
Product Overview
羟基甲苯磺丁脲 (CAS 5719-85-7), with molecular formula C12H18N2O4S and molecular weight 286.10 g/mol. IUPAC: 1-butyl-3-[4-(hydroxymethyl)phenyl]sulfonylurea.
Chemical Property Profile of 羟基甲苯磺丁脲
Property Insights of 羟基甲苯磺丁脲
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 羟基甲苯磺丁脲. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 羟基甲苯磺丁脲. Following Lipinski's Rule of Five, Hydroxytolbutamide has 3 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 Hydroxytolbutamide?
The CAS number of Hydroxytolbutamide is 5719-85-7.
What is the molecular formula of Hydroxytolbutamide?
The molecular formula of Hydroxytolbutamide is C12H18N2O4S.
What is the molecular weight of Hydroxytolbutamide?
The molecular weight of Hydroxytolbutamide is 286.10 g/mol.
Where can I buy Hydroxytolbutamide?
You can request a quote for Hydroxytolbutamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hydroxytolbutamide?
Yes, KEHONG BIO provides custom synthesis services for Hydroxytolbutamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.