ITF 1027
TL;DR: ITF 1027 (CAS 39204-55-2) is a chemical compound with molecular formula C16H14F3N3O2 and molecular weight 337.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[1-[3-(trifluoromethyl)phenyl]pyrazolo[5,4-b]pyridin-3-yl]oxypropan-1-ol
Also Known As: imidazo[1,5-a]pyrazine,3-methyl-,7-oxide, 3-({1-[3-(trifluoromethyl)phenyl]-1h-pyrazolo[3,4-b]pyridin-3-yl}oxy)propan-1-ol, 3-((1-(alpha,alpha,alpha-Trifluoro-m-tolyl)-1H-pyrazolo(3,4-b)pyridin-3-yl)oxy)propanol, 1-Propanol, 3-((1-(3-(trifluoromethyl)phenyl)-1H-pyrazolo(3,4-b)pyridin-3-yl)oxy)-, 3-((1-(3-(Trifluoromethyl)phenyl)-1H-pyrazolo[3,4-b]pyridin-3-yl)oxy)propan-1-ol
| Molecular Formula | C16H14F3N3O2 |
|---|---|
| Molecular Weight | 337.10 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 60.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 337.10382 |
| Heavy Atoms | 24 |
| Complexity | 411.0 |
Chemical Identifiers
| CAS Number | 39204-55-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)N2C3=C(C=CC=N3)C(=N2)OCCCO)C(F)(F)F |
| InChIKey | CKSQKNFCWOAKOE-UHFFFAOYSA-N |
Product Overview
ITF 1027 (CAS 39204-55-2), with molecular formula C16H14F3N3O2 and molecular weight 337.10 g/mol. IUPAC: 3-[1-[3-(trifluoromethyl)phenyl]pyrazolo[5,4-b]pyridin-3-yl]oxypropan-1-ol.
Chemical Property Profile of ITF 1027
Property Insights of ITF 1027
The XLogP value of 3.4 indicates that ITF 1027 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.2 Ų falls within the moderate polarity range, balancing permeability and solubility for ITF 1027. Following Lipinski's Rule of Five, ITF 1027 has 1 hydrogen bond donor(s) and 7 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 ITF 1027?
The CAS number of ITF 1027 is 39204-55-2.
What is the molecular formula of ITF 1027?
The molecular formula of ITF 1027 is C16H14F3N3O2.
What is the molecular weight of ITF 1027?
The molecular weight of ITF 1027 is 337.10 g/mol.
Where can I buy ITF 1027?
You can request a quote for ITF 1027 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ITF 1027?
Yes, KEHONG BIO provides custom synthesis services for ITF 1027 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.