![methyl 2,4-dimethyl-5-[(E)-(pyridin-3-ylimino)methyl]-1H-pyrrole-3-carboxylate structure](/static/products/3005/300588-28-7.webp)
methyl 2,4-dimethyl-5-[(E)-(pyridin-3-ylimino)methyl]-1H-pyrrole-3-carboxylate
TL;DR: methyl 2,4-dimethyl-5-[(E)-(pyridin-3-ylimino)methyl]-1H-pyrrole-3-carboxylate (CAS 300588-28-7) is a chemical compound with molecular formula C14H15N3O2 and molecular weight 257.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2,4-dimethyl-5-(pyridin-3-yliminomethyl)-1H-pyrrole-3-carboxylate
Also Known As: 1H-Pyrrole-3-carboxylicacid,2,4-dimethyl-5-[ methyl]-,methylester, methyl 2,4-dimethyl-5-[(pyridin-3-ylamino)methylidene]pyrrole-3-carboxylate, (E)-methyl 2,4-dimethyl-5-((pyridin-3-ylimino)methyl)-1H-pyrrole-3-carboxylate, methyl (5E)-2,4-dimethyl-5-[(pyridin-3-ylamino)methylidene]pyrrole-3-carboxylate, methyl (5Z)-2,4-dimethyl-5-[(pyridin-3-ylamino)methylidene]pyrrole-3-carboxylate
| Molecular Formula | C14H15N3O2 |
|---|---|
| Molecular Weight | 257.12 g/mol |
| LogP | 2.56374 |
| Topological Polar Surface Area | 67.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 257.11642 |
| Heavy Atoms | 19 |
| Complexity | 615.12134 |
Chemical Identifiers
| CAS Number | 300588-28-7 |
|---|---|
| SMILES | CC1=C(NC(=C1C(=O)OC)C)C=NC2=CN=CC=C2 |
Product Overview
methyl 2,4-dimethyl-5-[(E)-(pyridin-3-ylimino)methyl]-1H-pyrrole-3-carboxylate (CAS 300588-28-7), with molecular formula C14H15N3O2 and molecular weight 257.12 g/mol. IUPAC: methyl 2,4-dimethyl-5-(pyridin-3-yliminomethyl)-1H-pyrrole-3-carboxylate.
Chemical Property Profile of methyl 2,4-dimethyl-5-[(E)-(pyridin-3-ylimino)methyl]-1H-pyrrole-3-carboxylate
Property Insights of methyl 2,4-dimethyl-5-[(E)-(pyridin-3-ylimino)methyl]-1H-pyrrole-3-carboxylate
The XLogP value of 2.56374 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 2,4-dimethyl-5-[(E)-(pyridin-3-ylimino)methyl]-1H-pyrrole-3-carboxylate. The TPSA of 67.34 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 2,4-dimethyl-5-[(E)-(pyridin-3-ylimino)methyl]-1H-pyrrole-3-carboxylate. Following Lipinski's Rule of Five, methyl 2,4-dimethyl-5-[(E)-(pyridin-3-ylimino)methyl]-1H-pyrrole-3-carboxylate has 1 hydrogen bond donor(s) and 4 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 methyl 2,4-dimethyl-5-[(E)-(pyridin-3-ylimino)methyl]-1H-pyrrole-3-carboxylate?
The CAS number of methyl 2,4-dimethyl-5-[(E)-(pyridin-3-ylimino)methyl]-1H-pyrrole-3-carboxylate is 300588-28-7.
What is the molecular formula of methyl 2,4-dimethyl-5-[(E)-(pyridin-3-ylimino)methyl]-1H-pyrrole-3-carboxylate?
The molecular formula of methyl 2,4-dimethyl-5-[(E)-(pyridin-3-ylimino)methyl]-1H-pyrrole-3-carboxylate is C14H15N3O2.
What is the molecular weight of methyl 2,4-dimethyl-5-[(E)-(pyridin-3-ylimino)methyl]-1H-pyrrole-3-carboxylate?
The molecular weight of methyl 2,4-dimethyl-5-[(E)-(pyridin-3-ylimino)methyl]-1H-pyrrole-3-carboxylate is 257.12 g/mol.
Where can I buy methyl 2,4-dimethyl-5-[(E)-(pyridin-3-ylimino)methyl]-1H-pyrrole-3-carboxylate?
You can request a quote for methyl 2,4-dimethyl-5-[(E)-(pyridin-3-ylimino)methyl]-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 methyl 2,4-dimethyl-5-[(E)-(pyridin-3-ylimino)methyl]-1H-pyrrole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2,4-dimethyl-5-[(E)-(pyridin-3-ylimino)methyl]-1H-pyrrole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.