ethyl 2-(2,3-dihydro-1H-indol-1-yl)-4-oxo-6-phenyl-1,4,5,6-tetrahydro-5-pyrimidinecarboxylate
TL;DR: ethyl 2-(2,3-dihydro-1H-indol-1-yl)-4-oxo-6-phenyl-1,4,5,6-tetrahydro-5-pyrimidinecarboxylate (CAS 727385-47-9) is a chemical compound with molecular formula C21H21N3O3 and molecular weight 363.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(2,3-dihydroindol-1-yl)-6-oxo-4-phenyl-4,5-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: ethyl 2-(2,3-dihydro-1H-indol-1-yl)-4-oxo-6-phenyl-1,4,5,6-tetrahydro-5-pyrimidinecarboxylate, ethyl 2-(indolin-1-yl)-4-oxo-6-phenyl-1,4,5,6-tetrahydropyrimidine-5-carboxylate, ethyl 2-(2,3-dihydro-1H-indol-1-yl)-4-oxo-6-phenyl-1,4,5,6-tetrahydropyrimidine-5-carboxylate, ethyl 2-indolinyl-6-oxo-4-phenyl-3,4,5-trihydropyrimidine-5-carboxylate, ethyl 2-(2,3-dihydroindol-1-yl)-6-oxo-4-phenyl-4,5-dihydro-1H-pyrimidine-5-carboxylate
| Molecular Formula | C21H21N3O3 |
|---|---|
| Molecular Weight | 363.16 g/mol |
| LogP | 2.4555 |
| Topological Polar Surface Area | 71.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 363.1583 |
| Heavy Atoms | 27 |
| Complexity | 894.5547 |
Chemical Identifiers
| CAS Number | 727385-47-9 |
|---|---|
| SMILES | CCOC(=O)C1C(N=C(NC1=O)N2CCC3=CC=CC=C32)C4=CC=CC=C4 |
Product Overview
ethyl 2-(2,3-dihydro-1H-indol-1-yl)-4-oxo-6-phenyl-1,4,5,6-tetrahydro-5-pyrimidinecarboxylate (CAS 727385-47-9), with molecular formula C21H21N3O3 and molecular weight 363.16 g/mol. IUPAC: ethyl 2-(2,3-dihydroindol-1-yl)-6-oxo-4-phenyl-4,5-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of ethyl 2-(2,3-dihydro-1H-indol-1-yl)-4-oxo-6-phenyl-1,4,5,6-tetrahydro-5-pyrimidinecarboxylate
Property Insights of ethyl 2-(2,3-dihydro-1H-indol-1-yl)-4-oxo-6-phenyl-1,4,5,6-tetrahydro-5-pyrimidinecarboxylate
The XLogP value of 2.4555 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 2-(2,3-dihydro-1H-indol-1-yl)-4-oxo-6-phenyl-1,4,5,6-tetrahydro-5-pyrimidinecarboxylate. The TPSA of 71.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 2-(2,3-dihydro-1H-indol-1-yl)-4-oxo-6-phenyl-1,4,5,6-tetrahydro-5-pyrimidinecarboxylate. Following Lipinski's Rule of Five, ethyl 2-(2,3-dihydro-1H-indol-1-yl)-4-oxo-6-phenyl-1,4,5,6-tetrahydro-5-pyrimidinecarboxylate 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 ethyl 2-(2,3-dihydro-1H-indol-1-yl)-4-oxo-6-phenyl-1,4,5,6-tetrahydro-5-pyrimidinecarboxylate?
The CAS number of ethyl 2-(2,3-dihydro-1H-indol-1-yl)-4-oxo-6-phenyl-1,4,5,6-tetrahydro-5-pyrimidinecarboxylate is 727385-47-9.
What is the molecular formula of ethyl 2-(2,3-dihydro-1H-indol-1-yl)-4-oxo-6-phenyl-1,4,5,6-tetrahydro-5-pyrimidinecarboxylate?
The molecular formula of ethyl 2-(2,3-dihydro-1H-indol-1-yl)-4-oxo-6-phenyl-1,4,5,6-tetrahydro-5-pyrimidinecarboxylate is C21H21N3O3.
What is the molecular weight of ethyl 2-(2,3-dihydro-1H-indol-1-yl)-4-oxo-6-phenyl-1,4,5,6-tetrahydro-5-pyrimidinecarboxylate?
The molecular weight of ethyl 2-(2,3-dihydro-1H-indol-1-yl)-4-oxo-6-phenyl-1,4,5,6-tetrahydro-5-pyrimidinecarboxylate is 363.16 g/mol.
Where can I buy ethyl 2-(2,3-dihydro-1H-indol-1-yl)-4-oxo-6-phenyl-1,4,5,6-tetrahydro-5-pyrimidinecarboxylate?
You can request a quote for ethyl 2-(2,3-dihydro-1H-indol-1-yl)-4-oxo-6-phenyl-1,4,5,6-tetrahydro-5-pyrimidinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 2-(2,3-dihydro-1H-indol-1-yl)-4-oxo-6-phenyl-1,4,5,6-tetrahydro-5-pyrimidinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-(2,3-dihydro-1H-indol-1-yl)-4-oxo-6-phenyl-1,4,5,6-tetrahydro-5-pyrimidinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.