BAS 04378216
TL;DR: BAS 04378216 (CAS 347312-54-3) is a chemical compound with molecular formula C26H29NO3S and molecular weight 435.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenylethyl 2,7,7-trimethyl-4-(5-methylthiophen-2-yl)-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
Also Known As: BAS 04378216, A2551/0108608, 2-phenylethyl 2,7,7-trimethyl-4-(5-methylthiophen-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, 2-phenylethyl 2,7,7-trimethyl-4-(5-methylthien-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, 2-phenylethyl 2,7,7-trimethyl-4-(5-methyl(2-thienyl))-5-oxo-1,4,6,7,8-pentahyd roquinoline-3-carboxylate
| Molecular Formula | C26H29NO3S |
|---|---|
| Molecular Weight | 435.19 g/mol |
| LogP | 5.44642 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 435.18683 |
| Heavy Atoms | 31 |
| Complexity | 1075.0815 |
Chemical Identifiers
| CAS Number | 347312-54-3 |
|---|---|
| SMILES | CC1=CC=C(S1)C2C3=C(CC(CC3=O)(C)C)NC(=C2C(=O)OCCC4=CC=CC=C4)C |
Product Overview
BAS 04378216 (CAS 347312-54-3), with molecular formula C26H29NO3S and molecular weight 435.19 g/mol. IUPAC: 2-phenylethyl 2,7,7-trimethyl-4-(5-methylthiophen-2-yl)-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate.
Chemical Property Profile of BAS 04378216
Property Insights of BAS 04378216
The XLogP value of 5.44642 indicates that BAS 04378216 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 04378216 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 04378216 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 04378216?
The CAS number of BAS 04378216 is 347312-54-3.
What is the molecular formula of BAS 04378216?
The molecular formula of BAS 04378216 is C26H29NO3S.
What is the molecular weight of BAS 04378216?
The molecular weight of BAS 04378216 is 435.19 g/mol.
Where can I buy BAS 04378216?
You can request a quote for BAS 04378216 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04378216?
Yes, KEHONG BIO provides custom synthesis services for BAS 04378216 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.