BAS 01045159
TL;DR: BAS 01045159 (CAS 298204-29-2) is a chemical compound with molecular formula C23H25N3OS2 and molecular weight 423.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl)ethanone
Also Known As: BAS 01045159, 2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(2,2,4-trimethyl-4-phenyl-3,4-dihydroquinolin-1(2H)-yl)ethanone, 2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl)ethanone, 2,2,4-trimethyl-1-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl}-4-phenyl-1,2,3,4-tetrahydroquinoline, 2,2,4-trimethyl-1-{[(5-methyl-1,3,4-thiadiazol-2-yl)thio]acetyl}-4-phenyl-1,2,3,4-tetrahydroquinoline
| Molecular Formula | C23H25N3OS2 |
|---|---|
| Molecular Weight | 423.14 g/mol |
| LogP | 5.46012 |
| Topological Polar Surface Area | 46.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 423.1439 |
| Heavy Atoms | 29 |
| Complexity | 1031.367 |
Chemical Identifiers
| CAS Number | 298204-29-2 |
|---|---|
| SMILES | CC1=NN=C(S1)SCC(=O)N2C3=CC=CC=C3C(CC2(C)C)(C)C4=CC=CC=C4 |
Product Overview
BAS 01045159 (CAS 298204-29-2), with molecular formula C23H25N3OS2 and molecular weight 423.14 g/mol. IUPAC: 2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl)ethanone.
Chemical Property Profile of BAS 01045159
Property Insights of BAS 01045159
The XLogP value of 5.46012 indicates that BAS 01045159 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.09 Ų, BAS 01045159 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01045159 has 0 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 01045159?
The CAS number of BAS 01045159 is 298204-29-2.
What is the molecular formula of BAS 01045159?
The molecular formula of BAS 01045159 is C23H25N3OS2.
What is the molecular weight of BAS 01045159?
The molecular weight of BAS 01045159 is 423.14 g/mol.
Where can I buy BAS 01045159?
You can request a quote for BAS 01045159 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01045159?
Yes, KEHONG BIO provides custom synthesis services for BAS 01045159 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.