Dimethyl 3-(4-nitrobenzoyl)indolizine-1,2-dicarboxylate
TL;DR: Dimethyl 3-(4-nitrobenzoyl)indolizine-1,2-dicarboxylate (CAS 102767-53-3) is a chemical compound with molecular formula C19H14N2O7 and molecular weight 382.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 3-(4-nitrobenzoyl)indolizine-1,2-dicarboxylate
Also Known As: BAS 00034558, dimethyl 3-(4-nitrobenzoyl)indolizine-1,2-dicarboxylate, Dimethyl 3-(4-nitrobenzoyl)-1,2-indolizinedicarboxylate, 3-(4-Nitro-benzoyl)-indolizine-1,2-dicarboxylic acid dimethyl ester, dimethyl 3-[(4-nitrophenyl)carbonyl]indolizine-1,2-dicarboxylate
| Molecular Formula | C19H14N2O7 |
|---|---|
| Molecular Weight | 382.08 g/mol |
| LogP | 2.6517 |
| Topological Polar Surface Area | 117.22 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 382.0801 |
| Heavy Atoms | 28 |
| Complexity | 1113.2626 |
Chemical Identifiers
| CAS Number | 102767-53-3 |
|---|---|
| SMILES | COC(=O)C1=C2C=CC=CN2C(=C1C(=O)OC)C(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
Dimethyl 3-(4-nitrobenzoyl)indolizine-1,2-dicarboxylate (CAS 102767-53-3), with molecular formula C19H14N2O7 and molecular weight 382.08 g/mol. IUPAC: dimethyl 3-(4-nitrobenzoyl)indolizine-1,2-dicarboxylate.
Chemical Property Profile of Dimethyl 3-(4-nitrobenzoyl)indolizine-1,2-dicarboxylate
Property Insights of Dimethyl 3-(4-nitrobenzoyl)indolizine-1,2-dicarboxylate
The XLogP value of 2.6517 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl 3-(4-nitrobenzoyl)indolizine-1,2-dicarboxylate. The TPSA of 117.22 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 3-(4-nitrobenzoyl)indolizine-1,2-dicarboxylate. Following Lipinski's Rule of Five, Dimethyl 3-(4-nitrobenzoyl)indolizine-1,2-dicarboxylate has 0 hydrogen bond donor(s) and 7 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 Dimethyl 3-(4-nitrobenzoyl)indolizine-1,2-dicarboxylate?
The CAS number of Dimethyl 3-(4-nitrobenzoyl)indolizine-1,2-dicarboxylate is 102767-53-3.
What is the molecular formula of Dimethyl 3-(4-nitrobenzoyl)indolizine-1,2-dicarboxylate?
The molecular formula of Dimethyl 3-(4-nitrobenzoyl)indolizine-1,2-dicarboxylate is C19H14N2O7.
What is the molecular weight of Dimethyl 3-(4-nitrobenzoyl)indolizine-1,2-dicarboxylate?
The molecular weight of Dimethyl 3-(4-nitrobenzoyl)indolizine-1,2-dicarboxylate is 382.08 g/mol.
Where can I buy Dimethyl 3-(4-nitrobenzoyl)indolizine-1,2-dicarboxylate?
You can request a quote for Dimethyl 3-(4-nitrobenzoyl)indolizine-1,2-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 3-(4-nitrobenzoyl)indolizine-1,2-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 3-(4-nitrobenzoyl)indolizine-1,2-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.