ChemDiv1_027137
TL;DR: ChemDiv1_027137 (CAS 329368-32-3) is a chemical compound with molecular formula C20H20N2O5 and molecular weight 368.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(4-hydroxyanilino)-1-(4-hydroxyphenyl)-2-methyl-5-oxopyrrole-2-carboxylate
Also Known As: ChemDiv1_027137, ethyl 4-(4-hydroxyanilino)-1-(4-hydroxyphenyl)-2-methyl-5-oxopyrrole-2-carboxylate, 1-(4-Hydroxy-phenyl)-4-(4-hydroxy-phenylamino)-2-methyl-5-oxo-2,5-dihydro-1H-pyrrole-2-carboxylic acid ethyl ester, ethyl 1-(4-hydroxyphenyl)-4-((4-hydroxyphenyl)amino)-2-methyl-5-oxo-2,5-dihydro-1H-pyrrole-2-carboxylate, ethyl 4-(4-hydroxyanilino)-1-(4-hydroxyphenyl)-2-methyl-5-oxo-2,5-dihydro-1H-pyrrole-2-carboxylate
| Molecular Formula | C20H20N2O5 |
|---|---|
| Molecular Weight | 368.14 g/mol |
| LogP | 2.7622 |
| Topological Polar Surface Area | 99.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 368.1372 |
| Heavy Atoms | 27 |
| Complexity | 889.593 |
Chemical Identifiers
| CAS Number | 329368-32-3 |
|---|---|
| SMILES | CCOC(=O)C1(C=C(C(=O)N1C2=CC=C(C=C2)O)NC3=CC=C(C=C3)O)C |
Product Overview
ChemDiv1_027137 (CAS 329368-32-3), with molecular formula C20H20N2O5 and molecular weight 368.14 g/mol. IUPAC: ethyl 4-(4-hydroxyanilino)-1-(4-hydroxyphenyl)-2-methyl-5-oxopyrrole-2-carboxylate.
Chemical Property Profile of ChemDiv1_027137
Property Insights of ChemDiv1_027137
The XLogP value of 2.7622 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_027137. The TPSA of 99.1 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_027137. Following Lipinski's Rule of Five, ChemDiv1_027137 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 ChemDiv1_027137?
The CAS number of ChemDiv1_027137 is 329368-32-3.
What is the molecular formula of ChemDiv1_027137?
The molecular formula of ChemDiv1_027137 is C20H20N2O5.
What is the molecular weight of ChemDiv1_027137?
The molecular weight of ChemDiv1_027137 is 368.14 g/mol.
Where can I buy ChemDiv1_027137?
You can request a quote for ChemDiv1_027137 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_027137?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_027137 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.