![ethyl 4-amino-2-({2-[(2-bromophenyl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate structure](/static/products/872/872546-37-7.png)
ethyl 4-amino-2-({2-[(2-bromophenyl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate
TL;DR: ethyl 4-amino-2-({2-[(2-bromophenyl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate (CAS 872546-37-7) is a chemical compound with molecular formula C15H15BrN4O3S and molecular weight 410.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-amino-2-[2-(2-bromoanilino)-2-oxoethyl]sulfanylpyrimidine-5-carboxylate
Also Known As: ethyl 4-amino-2-({2-[(2-bromophenyl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate, ethyl 4-amino-2-((2-((2-bromophenyl)amino)-2-oxoethyl)thio)pyrimidine-5-carboxylate, ETHYL 4-AMINO-2-({[(2-BROMOPHENYL)CARBAMOYL]METHYL}SULFANYL)PYRIMIDINE-5-CARBOXYLATE, ethyl 4-amino-2-[2-(2-bromoanilino)-2-oxoethyl]sulfanylpyrimidine-5-carboxylate
| Molecular Formula | C15H15BrN4O3S |
|---|---|
| Molecular Weight | 410.00 g/mol |
| LogP | 2.7288 |
| Topological Polar Surface Area | 107.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 410.00482 |
| Heavy Atoms | 24 |
| Complexity | 757.2491 |
Chemical Identifiers
| CAS Number | 872546-37-7 |
|---|---|
| SMILES | CCOC(=O)C1=CN=C(N=C1N)SCC(=O)NC2=CC=CC=C2Br |
Product Overview
ethyl 4-amino-2-({2-[(2-bromophenyl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate (CAS 872546-37-7), with molecular formula C15H15BrN4O3S and molecular weight 410.00 g/mol. IUPAC: ethyl 4-amino-2-[2-(2-bromoanilino)-2-oxoethyl]sulfanylpyrimidine-5-carboxylate.
Chemical Property Profile of ethyl 4-amino-2-({2-[(2-bromophenyl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate
Property Insights of ethyl 4-amino-2-({2-[(2-bromophenyl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate
The XLogP value of 2.7288 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 4-amino-2-({2-[(2-bromophenyl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate. The TPSA of 107.2 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-amino-2-({2-[(2-bromophenyl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate. Following Lipinski's Rule of Five, ethyl 4-amino-2-({2-[(2-bromophenyl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate has 2 hydrogen bond donor(s) and 7 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 ethyl 4-amino-2-({2-[(2-bromophenyl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate?
The CAS number of ethyl 4-amino-2-({2-[(2-bromophenyl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate is 872546-37-7.
What is the molecular formula of ethyl 4-amino-2-({2-[(2-bromophenyl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate?
The molecular formula of ethyl 4-amino-2-({2-[(2-bromophenyl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate is C15H15BrN4O3S.
What is the molecular weight of ethyl 4-amino-2-({2-[(2-bromophenyl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate?
The molecular weight of ethyl 4-amino-2-({2-[(2-bromophenyl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate is 410.00 g/mol.
Where can I buy ethyl 4-amino-2-({2-[(2-bromophenyl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate?
You can request a quote for ethyl 4-amino-2-({2-[(2-bromophenyl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 4-amino-2-({2-[(2-bromophenyl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-amino-2-({2-[(2-bromophenyl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.