TimTec1_008299
TL;DR: TimTec1_008299 (CAS 436088-41-4) is a chemical compound with molecular formula C12H16F3N3O2 and molecular weight 291.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5R,7R)-5-tert-butyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxylic acid
Also Known As: TimTec1_008299, (5R,7R)-5-tert-butyl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxylic acid, 5-tert-Butyl-7-trifluoromethyl-4,5,6,7-tetrahydro-pyrazolo[1,5-a]pyrimidine-2-carboxylic acid
| Molecular Formula | C12H16F3N3O2 |
|---|---|
| Molecular Weight | 291.12 g/mol |
| LogP | 2.915 |
| Topological Polar Surface Area | 67.15 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 291.11948 |
| Heavy Atoms | 20 |
| Complexity | 531.03033 |
Chemical Identifiers
| CAS Number | 436088-41-4 |
|---|---|
| SMILES | CC(C)(C)[C@H]1C[C@@H](N2C(=CC(=N2)C(=O)O)N1)C(F)(F)F |
Product Overview
TimTec1_008299 (CAS 436088-41-4), with molecular formula C12H16F3N3O2 and molecular weight 291.12 g/mol. IUPAC: (5R,7R)-5-tert-butyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxylic acid.
Chemical Property Profile of TimTec1_008299
Property Insights of TimTec1_008299
The XLogP value of 2.915 suggests moderate lipophilicity, balancing water solubility and membrane permeability for TimTec1_008299. The TPSA of 67.15 Ų falls within the moderate polarity range, balancing permeability and solubility for TimTec1_008299. Following Lipinski's Rule of Five, TimTec1_008299 has 2 hydrogen bond donor(s) and 3 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 TimTec1_008299?
The CAS number of TimTec1_008299 is 436088-41-4.
What is the molecular formula of TimTec1_008299?
The molecular formula of TimTec1_008299 is C12H16F3N3O2.
What is the molecular weight of TimTec1_008299?
The molecular weight of TimTec1_008299 is 291.12 g/mol.
Where can I buy TimTec1_008299?
You can request a quote for TimTec1_008299 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TimTec1_008299?
Yes, KEHONG BIO provides custom synthesis services for TimTec1_008299 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.