BAS 11216139
TL;DR: BAS 11216139 (CAS 774563-13-2) is a chemical compound with molecular formula C20H21N5O3S and molecular weight 411.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-methyl-2-[[4-methyl-5-[(2-methylphenyl)carbamoyl]pyrimidin-2-yl]amino]-1,3-thiazole-5-carboxylate
Also Known As: BAS 11216139, ethyl 4-methyl-2-({4-methyl-5-[(2-methylphenyl)carbamoyl]pyrimidin-2-yl}amino)-1,3-thiazole-5-carboxylate, ethyl 4-methyl-2-((4-methyl-5-(o-tolylcarbamoyl)pyrimidin-2-yl)amino)thiazole-5-carboxylate, ethyl (2Z)-4-methyl-2-({4-methyl-5-[(2-methylphenyl)carbamoyl]pyrimidin-2-yl}imino)-2,3-dihydro-1,3-thiazole-5-carboxylate, ethyl 4-methyl-2-({4-methyl-5-[N-(2-methylphenyl)carbamoyl]pyrimidin-2-yl}amin o)-1,3-thiazole-5-carboxylate
| Molecular Formula | C20H21N5O3S |
|---|---|
| Molecular Weight | 411.14 g/mol |
| LogP | 4.03096 |
| Topological Polar Surface Area | 106.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 411.1365 |
| Heavy Atoms | 29 |
| Complexity | 1064.0203 |
Chemical Identifiers
| CAS Number | 774563-13-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C(S1)NC2=NC=C(C(=N2)C)C(=O)NC3=CC=CC=C3C)C |
Product Overview
BAS 11216139 (CAS 774563-13-2), with molecular formula C20H21N5O3S and molecular weight 411.14 g/mol. IUPAC: ethyl 4-methyl-2-[[4-methyl-5-[(2-methylphenyl)carbamoyl]pyrimidin-2-yl]amino]-1,3-thiazole-5-carboxylate.
Chemical Property Profile of BAS 11216139
Property Insights of BAS 11216139
The XLogP value of 4.03096 indicates that BAS 11216139 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.1 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 11216139. Following Lipinski's Rule of Five, BAS 11216139 has 2 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 11216139?
The CAS number of BAS 11216139 is 774563-13-2.
What is the molecular formula of BAS 11216139?
The molecular formula of BAS 11216139 is C20H21N5O3S.
What is the molecular weight of BAS 11216139?
The molecular weight of BAS 11216139 is 411.14 g/mol.
Where can I buy BAS 11216139?
You can request a quote for BAS 11216139 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 11216139?
Yes, KEHONG BIO provides custom synthesis services for BAS 11216139 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.