2-Butenedioic acid, (E)-, monomethyl ester, 2-((4-bromophenyl)sulfonyl)hydrazide
TL;DR: 2-Butenedioic acid, (E)-, monomethyl ester, 2-((4-bromophenyl)sulfonyl)hydrazide (CAS 114642-63-6) is a chemical compound with molecular formula C11H11BrN2O5S and molecular weight 361.9572 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl (E)-4-[2-(4-bromophenyl)sulfonylhydrazinyl]-4-oxobut-2-enoate
Also Known As: Monomethyl (E)-2-butenedioate 2-((4-bromophenyl)sulfonyl)hydrazide, 2-BUTENEDIOIC ACID, (E)-, MONOMETHYL ESTER, 2-((4-BROMOPHENYL)SULFONYL)HYDRAZIDE, methyl (E)-4-[2-(4-bromophenyl)sulfonylhydrazinyl]-4-oxobut-2-enoate
Technical Specifications
| Molecular Formula | C11H11BrN2O5S |
| Molecular Weight | 361.9572 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 110.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 361.9572 Da |
| Heavy Atoms | 20 |
| Complexity | 478.0 |
| SMILES | COC(=O)/C=C/C(=O)NNS(=O)(=O)C1=CC=C(C=C1)Br |
| InChIKey | PVWAHHMKMMJUJU-VOTSOKGWSA-N |
Chemical Property Profile of 2-Butenedioic acid, (E)-, monomethyl ester, 2-((4-bromophenyl)sulfonyl)hydrazide
Property Insights of 2-Butenedioic acid, (E)-, monomethyl ester, 2-((4-bromophenyl)sulfonyl)hydrazide
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Butenedioic acid, (E)-, monomethyl ester, 2-((4-bromophenyl)sulfonyl)hydrazide. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Butenedioic acid, (E)-, monomethyl ester, 2-((4-bromophenyl)sulfonyl)hydrazide. Following Lipinski's Rule of Five, 2-Butenedioic acid, (E)-, monomethyl ester, 2-((4-bromophenyl)sulfonyl)hydrazide has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Butenedioic acid, (E)-, monomethyl ester, 2-((4-bromophenyl)sulfonyl)hydrazide?
The CAS number of 2-Butenedioic acid, (E)-, monomethyl ester, 2-((4-bromophenyl)sulfonyl)hydrazide is 114642-63-6.
What is the molecular formula of 2-Butenedioic acid, (E)-, monomethyl ester, 2-((4-bromophenyl)sulfonyl)hydrazide?
The molecular formula of 2-Butenedioic acid, (E)-, monomethyl ester, 2-((4-bromophenyl)sulfonyl)hydrazide is C11H11BrN2O5S.
What is the molecular weight of 2-Butenedioic acid, (E)-, monomethyl ester, 2-((4-bromophenyl)sulfonyl)hydrazide?
The molecular weight of 2-Butenedioic acid, (E)-, monomethyl ester, 2-((4-bromophenyl)sulfonyl)hydrazide is 361.9572 g/mol.
Where can I buy 2-Butenedioic acid, (E)-, monomethyl ester, 2-((4-bromophenyl)sulfonyl)hydrazide?
You can request a quote for 2-Butenedioic acid, (E)-, monomethyl ester, 2-((4-bromophenyl)sulfonyl)hydrazide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Butenedioic acid, (E)-, monomethyl ester, 2-((4-bromophenyl)sulfonyl)hydrazide?
Yes, CoreyChem provides custom synthesis services for 2-Butenedioic acid, (E)-, monomethyl ester, 2-((4-bromophenyl)sulfonyl)hydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.