SS750
TL;DR: SS750 (CAS 229153-17-7) is a chemical compound with molecular formula C13H13F4N3O3S and molecular weight 367.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-2-(2,4-difluorophenyl)-1-ethylsulfonyl-1,1-difluoro-3-(1,2,4-triazol-1-yl)propan-2-ol
Also Known As: SS750, J1.670.895J, 1H-1,2,4-Triazole-1-ethanol, alpha-(2,4-difluorophenyl)-alpha-((ethylsulfonyl)difluoromethyl)-, (alphaR)-, (2R)-2-(2,4-difluorophenyl)-1-(ethanesulfonyl)-1,1-difluoro-3-(1H-1,2,4-triazol-1-yl)propan-2-ol, (R)-1,1-Difluoro-2-(2,4-difluorophenyl)-1-(ethylsulfonyl)-3-(1H-1,2,4-triazole-1-yl)-2-propanol
| Molecular Formula | C13H13F4N3O3S |
|---|---|
| Molecular Weight | 367.06 g/mol |
| LogP | 1.4716 |
| Topological Polar Surface Area | 85.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 367.06137 |
| Heavy Atoms | 24 |
| Complexity | 826.9924 |
Chemical Identifiers
| CAS Number | 229153-17-7 |
|---|---|
| SMILES | CCS(=O)(=O)C([C@](CN1C=NC=N1)(C2=C(C=C(C=C2)F)F)O)(F)F |
Product Overview
SS750 (CAS 229153-17-7), with molecular formula C13H13F4N3O3S and molecular weight 367.06 g/mol. IUPAC: (2R)-2-(2,4-difluorophenyl)-1-ethylsulfonyl-1,1-difluoro-3-(1,2,4-triazol-1-yl)propan-2-ol.
Chemical Property Profile of SS750
Property Insights of SS750
The XLogP value of 1.4716 suggests moderate lipophilicity, balancing water solubility and membrane permeability for SS750. The TPSA of 85.08 Ų falls within the moderate polarity range, balancing permeability and solubility for SS750. Following Lipinski's Rule of Five, SS750 has 1 hydrogen bond donor(s) and 5 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 SS750?
The CAS number of SS750 is 229153-17-7.
What is the molecular formula of SS750?
The molecular formula of SS750 is C13H13F4N3O3S.
What is the molecular weight of SS750?
The molecular weight of SS750 is 367.06 g/mol.
Where can I buy SS750?
You can request a quote for SS750 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SS750?
Yes, KEHONG BIO provides custom synthesis services for SS750 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.