BAS 04378039
TL;DR: BAS 04378039 (CAS 6370-98-5) is a chemical compound with molecular formula C22H19F2NO3S and molecular weight 415.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(3,4-difluorophenyl)-2-methyl-5-oxo-7-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 04378039, BIM-0021992.P001, methyl 4-(3,4-difluorophenyl)-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, methyl 4-(3,4-difluorophenyl)-2-methyl-5-oxo-7-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate, methyl 4-(3,4-difluorophenyl)-2-methyl-5-oxo-7-(2-thienyl)-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
| Molecular Formula | C22H19F2NO3S |
|---|---|
| Molecular Weight | 415.11 g/mol |
| LogP | 4.5609 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 415.10538 |
| Heavy Atoms | 29 |
| Complexity | 1056.0146 |
Chemical Identifiers
| CAS Number | 6370-98-5 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CS3)C4=CC(=C(C=C4)F)F)C(=O)OC |
Product Overview
BAS 04378039 (CAS 6370-98-5), with molecular formula C22H19F2NO3S and molecular weight 415.11 g/mol. IUPAC: methyl 4-(3,4-difluorophenyl)-2-methyl-5-oxo-7-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 04378039
Property Insights of BAS 04378039
The XLogP value of 4.5609 indicates that BAS 04378039 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 04378039 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 04378039 has 1 hydrogen bond donor(s) and 5 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 04378039?
The CAS number of BAS 04378039 is 6370-98-5.
What is the molecular formula of BAS 04378039?
The molecular formula of BAS 04378039 is C22H19F2NO3S.
What is the molecular weight of BAS 04378039?
The molecular weight of BAS 04378039 is 415.11 g/mol.
Where can I buy BAS 04378039?
You can request a quote for BAS 04378039 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04378039?
Yes, KEHONG BIO provides custom synthesis services for BAS 04378039 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.