KST-1B1124
TL;DR: KST-1B1124 (CAS 179556-37-7) is a chemical compound with molecular formula C16H22N2O3S and molecular weight 322.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-(3,5-dimethylphenyl)sulfonyl-1-methyl-4-propan-2-ylimidazol-2-yl]methanol
Also Known As: KST-1B1124, {5-[(3,5-dimethylphenyl)sulfonyl]-1-methyl-4-(1-methylethyl)-1h-imidazol-2-yl}methanol, 1H-Imidazole-2-methanol, 5-((3,5-dimethylphenyl)sulfonyl)-1-methyl-4-(1-methylethyl)-, (5-((3,5-Dimethylphenyl)sulfonyl)-4-isopropyl-1-methyl-1H-imidazol-2-yl)methanol, [5-(3,5-Dimethylbenzene-1-sulfonyl)-1-methyl-4-(propan-2-yl)-1H-imidazol-2-yl]methanol
| Molecular Formula | C16H22N2O3S |
|---|---|
| Molecular Weight | 322.14 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 80.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 322.1351 |
| Heavy Atoms | 22 |
| Complexity | 464.0 |
Chemical Identifiers
| CAS Number | 179556-37-7 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)S(=O)(=O)C2=C(N=C(N2C)CO)C(C)C)C |
| InChIKey | ODCOINHOONMDRD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
KST-1B1124 (CAS 179556-37-7), with molecular formula C16H22N2O3S and molecular weight 322.14 g/mol. IUPAC: [5-(3,5-dimethylphenyl)sulfonyl-1-methyl-4-propan-2-ylimidazol-2-yl]methanol.
Chemical Property Profile of KST-1B1124
Property Insights of KST-1B1124
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for KST-1B1124. The TPSA of 80.6 Ų falls within the moderate polarity range, balancing permeability and solubility for KST-1B1124. Following Lipinski's Rule of Five, KST-1B1124 has 1 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 KST-1B1124?
The CAS number of KST-1B1124 is 179556-37-7.
What is the molecular formula of KST-1B1124?
The molecular formula of KST-1B1124 is C16H22N2O3S.
What is the molecular weight of KST-1B1124?
The molecular weight of KST-1B1124 is 322.14 g/mol.
Where can I buy KST-1B1124?
You can request a quote for KST-1B1124 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1B1124?
Yes, KEHONG BIO provides custom synthesis services for KST-1B1124 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.