![1H-Pyrrole-3-carboxylicacid,5-[ acetyl]-2,4-dimethyl-,ethylester structure](/static/products/556/556018-87-2.png)
1H-Pyrrole-3-carboxylicacid,5-[ acetyl]-2,4-dimethyl-,ethylester
TL;DR: 1H-Pyrrole-3-carboxylicacid,5-[ acetyl]-2,4-dimethyl-,ethylester (CAS 556018-87-2) is a chemical compound with molecular formula C15H18N2O5 and molecular weight 306.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-[2-(2,5-dioxopyrrolidin-1-yl)acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate
Also Known As: 1H-Pyrrole-3-carboxylicacid,5-[ acetyl]-2,4-dimethyl-,ethylester, ethyl 5-[2-(2,5-dioxopyrrolidin-1-yl)acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate, 1H-Pyrrole-3-carboxylic acid, 5-[(2,5-dioxo-1-pyrrolidinyl)acetyl]-2,4-dimethyl-, ethyl ester (9CI)
| Molecular Formula | C15H18N2O5 |
|---|---|
| Molecular Weight | 306.12 g/mol |
| LogP | 1.13994 |
| Topological Polar Surface Area | 96.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 306.12158 |
| Heavy Atoms | 22 |
| Complexity | 643.13525 |
Chemical Identifiers
| CAS Number | 556018-87-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=C1C)C(=O)CN2C(=O)CCC2=O)C |
Product Overview
1H-Pyrrole-3-carboxylicacid,5-[ acetyl]-2,4-dimethyl-,ethylester (CAS 556018-87-2), with molecular formula C15H18N2O5 and molecular weight 306.12 g/mol. IUPAC: ethyl 5-[2-(2,5-dioxopyrrolidin-1-yl)acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate.
Chemical Property Profile of 1H-Pyrrole-3-carboxylicacid,5-[ acetyl]-2,4-dimethyl-,ethylester
Property Insights of 1H-Pyrrole-3-carboxylicacid,5-[ acetyl]-2,4-dimethyl-,ethylester
The XLogP value of 1.13994 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Pyrrole-3-carboxylicacid,5-[ acetyl]-2,4-dimethyl-,ethylester. The TPSA of 96.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Pyrrole-3-carboxylicacid,5-[ acetyl]-2,4-dimethyl-,ethylester. Following Lipinski's Rule of Five, 1H-Pyrrole-3-carboxylicacid,5-[ acetyl]-2,4-dimethyl-,ethylester has 1 hydrogen bond donor(s) and 5 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 1H-Pyrrole-3-carboxylicacid,5-[ acetyl]-2,4-dimethyl-,ethylester?
The CAS number of 1H-Pyrrole-3-carboxylicacid,5-[ acetyl]-2,4-dimethyl-,ethylester is 556018-87-2.
What is the molecular formula of 1H-Pyrrole-3-carboxylicacid,5-[ acetyl]-2,4-dimethyl-,ethylester?
The molecular formula of 1H-Pyrrole-3-carboxylicacid,5-[ acetyl]-2,4-dimethyl-,ethylester is C15H18N2O5.
What is the molecular weight of 1H-Pyrrole-3-carboxylicacid,5-[ acetyl]-2,4-dimethyl-,ethylester?
The molecular weight of 1H-Pyrrole-3-carboxylicacid,5-[ acetyl]-2,4-dimethyl-,ethylester is 306.12 g/mol.
Where can I buy 1H-Pyrrole-3-carboxylicacid,5-[ acetyl]-2,4-dimethyl-,ethylester?
You can request a quote for 1H-Pyrrole-3-carboxylicacid,5-[ acetyl]-2,4-dimethyl-,ethylester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Pyrrole-3-carboxylicacid,5-[ acetyl]-2,4-dimethyl-,ethylester?
Yes, KEHONG BIO provides custom synthesis services for 1H-Pyrrole-3-carboxylicacid,5-[ acetyl]-2,4-dimethyl-,ethylester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.