RefChem:240090
TL;DR: RefChem:240090 (CAS 114319-14-1) is a chemical compound with molecular formula C25H33N3O3 and molecular weight 423.2522 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[3-(3,5-ditert-butyl-4-hydroxyphenyl)pyrazolo[5,4-b]pyridin-1-yl]ethyl propanoate
Also Known As: 3-(3,5-Di-tertiary-butyl-4-hydroxyphenyl)-1-(2'-propionyloxyethyl)-1H-pyrazolo(3,4-b)pyridine, 1H-Pyrazolo(3,4-b)pyridine-1-ethanol, 3-(3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl)-, alpha-propanoate, 2-[3-(3,5-Di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)-2,3-dihydro-1H-pyrazolo[3,4-b]pyridin-1-yl]ethyl propanoate, 2-[3-(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)-2H-pyrazolo[3,4-b]pyridin-1-yl]ethyl propanoate
Technical Specifications
| Molecular Formula | C25H33N3O3 |
| Molecular Weight | 423.2522 g/mol |
| XLogP | 5.8 |
| Topological Polar Surface Area (TPSA) | 77.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 423.2522 Da |
| Heavy Atoms | 31 |
| Complexity | 588.0 |
| SMILES | CCC(=O)OCCN1C2=C(C=CC=N2)C(=N1)C3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C |
| InChIKey | AOBRSYHNHQXZMJ-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:240090
Property Insights of RefChem:240090
The XLogP value of 5.8 indicates that RefChem:240090 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.2 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:240090. Following Lipinski's Rule of Five, RefChem:240090 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:240090?
The CAS number of RefChem:240090 is 114319-14-1.
What is the molecular formula of RefChem:240090?
The molecular formula of RefChem:240090 is C25H33N3O3.
What is the molecular weight of RefChem:240090?
The molecular weight of RefChem:240090 is 423.2522 g/mol.
Where can I buy RefChem:240090?
You can request a quote for RefChem:240090 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:240090?
Yes, CoreyChem provides custom synthesis services for RefChem:240090 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.