BAS 00414937
TL;DR: BAS 00414937 (CAS 313246-14-9) is a chemical compound with molecular formula C23H17F3N4O and molecular weight 422.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dihydro-2H-quinolin-1-yl-[5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]methanone
Also Known As: BAS 00414937, 3,4-dihydro-2H-quinolin-1-yl-[5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]methanone, 3,4-dihydroquinolin-1(2H)-yl[5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]methanone, (3,4-dihydroquinolin-1(2H)-yl)(5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl)methanone, 1-[5-PHENYL-7-(TRIFLUOROMETHYL)PYRAZOLO[1,5-A]PYRIMIDINE-2-CARBONYL]-3,4-DIHYDRO-2H-QUINOLINE
| Molecular Formula | C23H17F3N4O |
|---|---|
| Molecular Weight | 422.14 g/mol |
| LogP | 5.0081 |
| Topological Polar Surface Area | 50.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 422.13544 |
| Heavy Atoms | 31 |
| Complexity | 1281.2213 |
Chemical Identifiers
| CAS Number | 313246-14-9 |
|---|---|
| SMILES | C1CC2=CC=CC=C2N(C1)C(=O)C3=NN4C(=CC(=NC4=C3)C5=CC=CC=C5)C(F)(F)F |
Product Overview
BAS 00414937 (CAS 313246-14-9), with molecular formula C23H17F3N4O and molecular weight 422.14 g/mol. IUPAC: 3,4-dihydro-2H-quinolin-1-yl-[5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]methanone.
Chemical Property Profile of BAS 00414937
Property Insights of BAS 00414937
The XLogP value of 5.0081 indicates that BAS 00414937 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.5 Ų, BAS 00414937 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00414937 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00414937?
The CAS number of BAS 00414937 is 313246-14-9.
What is the molecular formula of BAS 00414937?
The molecular formula of BAS 00414937 is C23H17F3N4O.
What is the molecular weight of BAS 00414937?
The molecular weight of BAS 00414937 is 422.14 g/mol.
Where can I buy BAS 00414937?
You can request a quote for BAS 00414937 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00414937?
Yes, KEHONG BIO provides custom synthesis services for BAS 00414937 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.