BAS 04378509
TL;DR: BAS 04378509 (CAS 347353-47-3) is a chemical compound with molecular formula C23H20F3NO3S and molecular weight 447.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-methyl-5-oxo-7-thiophen-2-yl-4-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 04378509, A2563/0109229, methyl 2-methyl-5-oxo-7-(2-thienyl)-4-[4-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate, methyl 2-methyl-5-oxo-7-(thiophen-2-yl)-4-[4-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, methyl 2-methyl-5-oxo-7-thiophen-2-yl-4-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
| Molecular Formula | C23H20F3NO3S |
|---|---|
| Molecular Weight | 447.11 g/mol |
| LogP | 5.3015 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 447.1116 |
| Heavy Atoms | 31 |
| Complexity | 1082.27 |
Chemical Identifiers
| CAS Number | 347353-47-3 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CS3)C4=CC=C(C=C4)C(F)(F)F)C(=O)OC |
Product Overview
BAS 04378509 (CAS 347353-47-3), with molecular formula C23H20F3NO3S and molecular weight 447.11 g/mol. IUPAC: methyl 2-methyl-5-oxo-7-thiophen-2-yl-4-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 04378509
Property Insights of BAS 04378509
The XLogP value of 5.3015 indicates that BAS 04378509 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 04378509 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 04378509 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 04378509?
The CAS number of BAS 04378509 is 347353-47-3.
What is the molecular formula of BAS 04378509?
The molecular formula of BAS 04378509 is C23H20F3NO3S.
What is the molecular weight of BAS 04378509?
The molecular weight of BAS 04378509 is 447.11 g/mol.
Where can I buy BAS 04378509?
You can request a quote for BAS 04378509 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04378509?
Yes, KEHONG BIO provides custom synthesis services for BAS 04378509 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.