BAS 03754220
TL;DR: BAS 03754220 (CAS 459418-46-3) is a chemical compound with molecular formula C18H18N2O3S and molecular weight 342.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-methyl-3-[(3-methylphenyl)methyl]-4-oxothieno[2,3-d]pyrimidine-6-carboxylate
Also Known As: BAS 03754220, AP-906/41078796, ethyl 5-methyl-3-(3-methylbenzyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate, ethyl 5-methyl-3-[(3-methylphenyl)methyl]-4-oxothieno[2,3-d]pyrimidine-6-carboxylate, ethyl 5-methyl-3-[(3-methylphenyl)methyl]-4-oxo-3-hydrothiopheno[2,3-d]pyrimid ine-6-carboxylate
| Molecular Formula | C18H18N2O3S |
|---|---|
| Molecular Weight | 342.10 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 87.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 342.10382 |
| Heavy Atoms | 24 |
| Complexity | 524.0 |
Chemical Identifiers
| CAS Number | 459418-46-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)CC3=CC=CC(=C3)C)C |
| InChIKey | AELIJDMPXNDZKA-UHFFFAOYSA-N |
Product Overview
BAS 03754220 (CAS 459418-46-3), with molecular formula C18H18N2O3S and molecular weight 342.10 g/mol. IUPAC: ethyl 5-methyl-3-[(3-methylphenyl)methyl]-4-oxothieno[2,3-d]pyrimidine-6-carboxylate.
Chemical Property Profile of BAS 03754220
Property Insights of BAS 03754220
The XLogP value of 3.7 indicates that BAS 03754220 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.2 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03754220. Following Lipinski's Rule of Five, BAS 03754220 has 0 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 03754220?
The CAS number of BAS 03754220 is 459418-46-3.
What is the molecular formula of BAS 03754220?
The molecular formula of BAS 03754220 is C18H18N2O3S.
What is the molecular weight of BAS 03754220?
The molecular weight of BAS 03754220 is 342.10 g/mol.
Where can I buy BAS 03754220?
You can request a quote for BAS 03754220 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03754220?
Yes, KEHONG BIO provides custom synthesis services for BAS 03754220 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.