BAS 00287153
TL;DR: BAS 00287153 (CAS 129788-82-5) is a chemical compound with molecular formula C15H15F6NO and molecular weight 339.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3,3-dimethyl-4H-isoquinolin-1-yl)methyl]-1,1,1,3,3,3-hexafluoropropan-2-ol
Also Known As: BAS 00287153, 2-[(3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)methyl]-1,1,1,3,3,3-hexafluoropropan-2-ol, 1-(2-hydroxy-2-trifluoromethyl-3,3,3-trifluoropropyl)-3,3-dimethyl-3,4-dihydroisoquinoline, 2-((3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)methyl)-1,1,1,3,3,3-hexafluoropropan-2-ol, 2-[(3,3-dimethyl-3,4-dihydro-1-isoquinolinyl)methyl]-1,1,1,3,3,3-hexafluoro-2-propanol
| Molecular Formula | C15H15F6NO |
|---|---|
| Molecular Weight | 339.11 g/mol |
| LogP | 4.0562 |
| Topological Polar Surface Area | 32.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 339.10577 |
| Heavy Atoms | 23 |
| Complexity | 615.58966 |
Chemical Identifiers
| CAS Number | 129788-82-5 |
|---|---|
| SMILES | CC1(CC2=CC=CC=C2C(=N1)CC(C(F)(F)F)(C(F)(F)F)O)C |
Product Overview
BAS 00287153 (CAS 129788-82-5), with molecular formula C15H15F6NO and molecular weight 339.11 g/mol. IUPAC: 2-[(3,3-dimethyl-4H-isoquinolin-1-yl)methyl]-1,1,1,3,3,3-hexafluoropropan-2-ol.
Chemical Property Profile of BAS 00287153
Property Insights of BAS 00287153
The XLogP value of 4.0562 indicates that BAS 00287153 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.59 Ų, BAS 00287153 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00287153 has 1 hydrogen bond donor(s) and 2 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 00287153?
The CAS number of BAS 00287153 is 129788-82-5.
What is the molecular formula of BAS 00287153?
The molecular formula of BAS 00287153 is C15H15F6NO.
What is the molecular weight of BAS 00287153?
The molecular weight of BAS 00287153 is 339.11 g/mol.
Where can I buy BAS 00287153?
You can request a quote for BAS 00287153 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00287153?
Yes, KEHONG BIO provides custom synthesis services for BAS 00287153 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.