(E)-methyl 2,4-dimethyl-5-(3-(4-phenoxyphenyl)acryloyl)-1H-pyrrole-3-carboxylate
TL;DR: (E)-methyl 2,4-dimethyl-5-(3-(4-phenoxyphenyl)acryloyl)-1H-pyrrole-3-carboxylate (CAS 371940-89-5) is a chemical compound with molecular formula C23H21NO4 and molecular weight 375.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2,4-dimethyl-5-[(E)-3-(4-phenoxyphenyl)prop-2-enoyl]-1H-pyrrole-3-carboxylate
Also Known As: (E)-methyl 2,4-dimethyl-5-(3-(4-phenoxyphenyl)acryloyl)-1H-pyrrole-3-carboxylate, methyl 2,4-dimethyl-5-[(2E)-3-(4-phenoxyphenyl)prop-2-enoyl]-1H-pyrrole-3-carboxylate, methyl 2,4-dimethyl-5-[(E)-3-(4-phenoxyphenyl)prop-2-enoyl]-1H-pyrrole-3-carboxylate
| Molecular Formula | C23H21NO4 |
|---|---|
| Molecular Weight | 375.15 g/mol |
| LogP | 5.10654 |
| Topological Polar Surface Area | 68.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 375.14706 |
| Heavy Atoms | 28 |
| Complexity | 1014.7608 |
Chemical Identifiers
| CAS Number | 371940-89-5 |
|---|---|
| SMILES | CC1=C(NC(=C1C(=O)OC)C)C(=O)/C=C/C2=CC=C(C=C2)OC3=CC=CC=C3 |
Product Overview
(E)-methyl 2,4-dimethyl-5-(3-(4-phenoxyphenyl)acryloyl)-1H-pyrrole-3-carboxylate (CAS 371940-89-5), with molecular formula C23H21NO4 and molecular weight 375.15 g/mol. IUPAC: methyl 2,4-dimethyl-5-[(E)-3-(4-phenoxyphenyl)prop-2-enoyl]-1H-pyrrole-3-carboxylate.
Chemical Property Profile of (E)-methyl 2,4-dimethyl-5-(3-(4-phenoxyphenyl)acryloyl)-1H-pyrrole-3-carboxylate
Property Insights of (E)-methyl 2,4-dimethyl-5-(3-(4-phenoxyphenyl)acryloyl)-1H-pyrrole-3-carboxylate
The XLogP value of 5.10654 indicates that (E)-methyl 2,4-dimethyl-5-(3-(4-phenoxyphenyl)acryloyl)-1H-pyrrole-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.39 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-methyl 2,4-dimethyl-5-(3-(4-phenoxyphenyl)acryloyl)-1H-pyrrole-3-carboxylate. Following Lipinski's Rule of Five, (E)-methyl 2,4-dimethyl-5-(3-(4-phenoxyphenyl)acryloyl)-1H-pyrrole-3-carboxylate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-methyl 2,4-dimethyl-5-(3-(4-phenoxyphenyl)acryloyl)-1H-pyrrole-3-carboxylate?
The CAS number of (E)-methyl 2,4-dimethyl-5-(3-(4-phenoxyphenyl)acryloyl)-1H-pyrrole-3-carboxylate is 371940-89-5.
What is the molecular formula of (E)-methyl 2,4-dimethyl-5-(3-(4-phenoxyphenyl)acryloyl)-1H-pyrrole-3-carboxylate?
The molecular formula of (E)-methyl 2,4-dimethyl-5-(3-(4-phenoxyphenyl)acryloyl)-1H-pyrrole-3-carboxylate is C23H21NO4.
What is the molecular weight of (E)-methyl 2,4-dimethyl-5-(3-(4-phenoxyphenyl)acryloyl)-1H-pyrrole-3-carboxylate?
The molecular weight of (E)-methyl 2,4-dimethyl-5-(3-(4-phenoxyphenyl)acryloyl)-1H-pyrrole-3-carboxylate is 375.15 g/mol.
Where can I buy (E)-methyl 2,4-dimethyl-5-(3-(4-phenoxyphenyl)acryloyl)-1H-pyrrole-3-carboxylate?
You can request a quote for (E)-methyl 2,4-dimethyl-5-(3-(4-phenoxyphenyl)acryloyl)-1H-pyrrole-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-methyl 2,4-dimethyl-5-(3-(4-phenoxyphenyl)acryloyl)-1H-pyrrole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (E)-methyl 2,4-dimethyl-5-(3-(4-phenoxyphenyl)acryloyl)-1H-pyrrole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.