BAS 01404553
TL;DR: BAS 01404553 (CAS 299947-74-3) is a chemical compound with molecular formula C23H24F3NO3 and molecular weight 419.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclopentyl 2-methyl-5-oxo-4-[2-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 01404553, BIM-0020924.P001, cyclopentyl 2-methyl-5-oxo-4-[2-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate, cyclopentyl 2-methyl-5-oxo-4-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate, cyclopentyl 2-methyl-5-oxo-4-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
| Molecular Formula | C23H24F3NO3 |
|---|---|
| Molecular Weight | 419.17 g/mol |
| LogP | 5.1591 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 419.17084 |
| Heavy Atoms | 30 |
| Complexity | 939.2569 |
Chemical Identifiers
| CAS Number | 299947-74-3 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=CC=C3C(F)(F)F)C(=O)OC4CCCC4 |
Product Overview
BAS 01404553 (CAS 299947-74-3), with molecular formula C23H24F3NO3 and molecular weight 419.17 g/mol. IUPAC: cyclopentyl 2-methyl-5-oxo-4-[2-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 01404553
Property Insights of BAS 01404553
The XLogP value of 5.1591 indicates that BAS 01404553 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, BAS 01404553 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01404553 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01404553?
The CAS number of BAS 01404553 is 299947-74-3.
What is the molecular formula of BAS 01404553?
The molecular formula of BAS 01404553 is C23H24F3NO3.
What is the molecular weight of BAS 01404553?
The molecular weight of BAS 01404553 is 419.17 g/mol.
Where can I buy BAS 01404553?
You can request a quote for BAS 01404553 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01404553?
Yes, KEHONG BIO provides custom synthesis services for BAS 01404553 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.