![2-butenoic acid, 4-[[4-[[(4-methyl-2-pyrimidinyl)amino]sulfonyl]phenyl]amino]-4-oxo-, (2E)- structure](/static/products/109/109436-70-6.png)
2-butenoic acid, 4-[[4-[[(4-methyl-2-pyrimidinyl)amino]sulfonyl]phenyl]amino]-4-oxo-, (2E)-
TL;DR: 2-butenoic acid, 4-[[4-[[(4-methyl-2-pyrimidinyl)amino]sulfonyl]phenyl]amino]-4-oxo-, (2E)- (CAS 109436-70-6) is a chemical compound with molecular formula C15H14N4O5S and molecular weight 362.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-4-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]anilino]-4-oxobut-2-enoic acid
Also Known As: 2-butenoic acid, 4-[[4-[[(4-methyl-2-pyrimidinyl)amino]sulfonyl]phenyl]amino]-4-oxo-, (2E)-, (E)-4-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]anilino]-4-oxobut-2-enoic acid, (2E)-4-[(4-[[(4-METHYLPYRIMIDIN-2-YL)AMINO]SULFONYL]PHENYL)AMINO]-4-OXOBUT-2-ENOIC ACID
| Molecular Formula | C15H14N4O5S |
|---|---|
| Molecular Weight | 362.07 g/mol |
| LogP | 1.16512 |
| Topological Polar Surface Area | 138.35 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 362.06848 |
| Heavy Atoms | 25 |
| Complexity | 923.1928 |
Chemical Identifiers
| CAS Number | 109436-70-6 |
|---|---|
| SMILES | CC1=NC(=NC=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)/C=C/C(=O)O |
Product Overview
2-butenoic acid, 4-[[4-[[(4-methyl-2-pyrimidinyl)amino]sulfonyl]phenyl]amino]-4-oxo-, (2E)- (CAS 109436-70-6), with molecular formula C15H14N4O5S and molecular weight 362.07 g/mol. IUPAC: (E)-4-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]anilino]-4-oxobut-2-enoic acid.
Chemical Property Profile of 2-butenoic acid, 4-[[4-[[(4-methyl-2-pyrimidinyl)amino]sulfonyl]phenyl]amino]-4-oxo-, (2E)-
Property Insights of 2-butenoic acid, 4-[[4-[[(4-methyl-2-pyrimidinyl)amino]sulfonyl]phenyl]amino]-4-oxo-, (2E)-
The XLogP value of 1.16512 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-butenoic acid, 4-[[4-[[(4-methyl-2-pyrimidinyl)amino]sulfonyl]phenyl]amino]-4-oxo-, (2E)-. The TPSA of 138.35 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-butenoic acid, 4-[[4-[[(4-methyl-2-pyrimidinyl)amino]sulfonyl]phenyl]amino]-4-oxo-, (2E)-. Following Lipinski's Rule of Five, 2-butenoic acid, 4-[[4-[[(4-methyl-2-pyrimidinyl)amino]sulfonyl]phenyl]amino]-4-oxo-, (2E)- has 3 hydrogen bond donor(s) and 6 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 2-butenoic acid, 4-[[4-[[(4-methyl-2-pyrimidinyl)amino]sulfonyl]phenyl]amino]-4-oxo-, (2E)-?
The CAS number of 2-butenoic acid, 4-[[4-[[(4-methyl-2-pyrimidinyl)amino]sulfonyl]phenyl]amino]-4-oxo-, (2E)- is 109436-70-6.
What is the molecular formula of 2-butenoic acid, 4-[[4-[[(4-methyl-2-pyrimidinyl)amino]sulfonyl]phenyl]amino]-4-oxo-, (2E)-?
The molecular formula of 2-butenoic acid, 4-[[4-[[(4-methyl-2-pyrimidinyl)amino]sulfonyl]phenyl]amino]-4-oxo-, (2E)- is C15H14N4O5S.
What is the molecular weight of 2-butenoic acid, 4-[[4-[[(4-methyl-2-pyrimidinyl)amino]sulfonyl]phenyl]amino]-4-oxo-, (2E)-?
The molecular weight of 2-butenoic acid, 4-[[4-[[(4-methyl-2-pyrimidinyl)amino]sulfonyl]phenyl]amino]-4-oxo-, (2E)- is 362.07 g/mol.
Where can I buy 2-butenoic acid, 4-[[4-[[(4-methyl-2-pyrimidinyl)amino]sulfonyl]phenyl]amino]-4-oxo-, (2E)-?
You can request a quote for 2-butenoic acid, 4-[[4-[[(4-methyl-2-pyrimidinyl)amino]sulfonyl]phenyl]amino]-4-oxo-, (2E)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-butenoic acid, 4-[[4-[[(4-methyl-2-pyrimidinyl)amino]sulfonyl]phenyl]amino]-4-oxo-, (2E)-?
Yes, KEHONG BIO provides custom synthesis services for 2-butenoic acid, 4-[[4-[[(4-methyl-2-pyrimidinyl)amino]sulfonyl]phenyl]amino]-4-oxo-, (2E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.