BAS 01248727
TL;DR: BAS 01248727 (CAS 332162-21-7) is a chemical compound with molecular formula C18H21N3O4S2 and molecular weight 407.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-acetyl-2-[[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]amino]-4-methylthiophene-3-carboxylate
Also Known As: BAS 01248727, Ethyl 5-acetyl-2-(2-((4,6-dimethylpyrimidin-2-yl)thio)acetamido)-4-methylthiophene-3-carboxylate, BRD-K61640649-001-01-9, 5-Acetyl-2-[2-(4,6-dimethyl-pyrimidin-2-ylsulfanyl)-acetylamino]-4-methyl-thiophene-3-carboxylic acid ethyl ester, ethyl 5-acetyl-2-({[(4,6-dimethyl-2-pyrimidinyl)sulfanyl]acetyl}amino)-4-methyl-3-thiophenecarboxylate
| Molecular Formula | C18H21N3O4S2 |
|---|---|
| Molecular Weight | 407.10 g/mol |
| LogP | 3.57346 |
| Topological Polar Surface Area | 98.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 407.09735 |
| Heavy Atoms | 27 |
| Complexity | 872.72217 |
Chemical Identifiers
| CAS Number | 332162-21-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)CSC2=NC(=CC(=N2)C)C |
Product Overview
BAS 01248727 (CAS 332162-21-7), with molecular formula C18H21N3O4S2 and molecular weight 407.10 g/mol. IUPAC: ethyl 5-acetyl-2-[[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]amino]-4-methylthiophene-3-carboxylate.
Chemical Property Profile of BAS 01248727
Property Insights of BAS 01248727
The XLogP value of 3.57346 indicates that BAS 01248727 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.25 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01248727. Following Lipinski's Rule of Five, BAS 01248727 has 1 hydrogen bond donor(s) and 8 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 01248727?
The CAS number of BAS 01248727 is 332162-21-7.
What is the molecular formula of BAS 01248727?
The molecular formula of BAS 01248727 is C18H21N3O4S2.
What is the molecular weight of BAS 01248727?
The molecular weight of BAS 01248727 is 407.10 g/mol.
Where can I buy BAS 01248727?
You can request a quote for BAS 01248727 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01248727?
Yes, KEHONG BIO provides custom synthesis services for BAS 01248727 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.