BAS 02026129
TL;DR: BAS 02026129 (CAS 296772-19-5) is a chemical compound with molecular formula C15H15F3N2O3 and molecular weight 328.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-hydroxyphenyl)-[3-hydroxy-3-(trifluoromethyl)-4,5,6,7-tetrahydro-3aH-indazol-2-yl]methanone
Also Known As: BAS 02026129, (2-hydroxyphenyl)-[3-hydroxy-3-(trifluoromethyl)-4,5,6,7-tetrahydro-3aH-indazol-2-yl]methanone, (2-hydroxyphenyl)[3-hydroxy-3-(trifluoromethyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]methanone, (3-hydroxy-3-(trifluoromethyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl)(2-hydroxyphenyl)methanone
| Molecular Formula | C15H15F3N2O3 |
|---|---|
| Molecular Weight | 328.10 g/mol |
| LogP | 2.6451 |
| Topological Polar Surface Area | 73.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 328.1035 |
| Heavy Atoms | 23 |
| Complexity | 674.1761 |
Chemical Identifiers
| CAS Number | 296772-19-5 |
|---|---|
| SMILES | C1CCC2=NN(C(C2C1)(C(F)(F)F)O)C(=O)C3=CC=CC=C3O |
Product Overview
BAS 02026129 (CAS 296772-19-5), with molecular formula C15H15F3N2O3 and molecular weight 328.10 g/mol. IUPAC: (2-hydroxyphenyl)-[3-hydroxy-3-(trifluoromethyl)-4,5,6,7-tetrahydro-3aH-indazol-2-yl]methanone.
Chemical Property Profile of BAS 02026129
Property Insights of BAS 02026129
The XLogP value of 2.6451 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 02026129. The TPSA of 73.13 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02026129. Following Lipinski's Rule of Five, BAS 02026129 has 2 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 BAS 02026129?
The CAS number of BAS 02026129 is 296772-19-5.
What is the molecular formula of BAS 02026129?
The molecular formula of BAS 02026129 is C15H15F3N2O3.
What is the molecular weight of BAS 02026129?
The molecular weight of BAS 02026129 is 328.10 g/mol.
Where can I buy BAS 02026129?
You can request a quote for BAS 02026129 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02026129?
Yes, KEHONG BIO provides custom synthesis services for BAS 02026129 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.