dimethyl 5-phenyl-2,3-dihydro-1H-pyrrolizine-6,7-dicarboxylate
TL;DR: dimethyl 5-phenyl-2,3-dihydro-1H-pyrrolizine-6,7-dicarboxylate (CAS 60026-93-9) is a chemical compound with molecular formula C17H17NO4 and molecular weight 299.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 3-phenyl-6,7-dihydro-5H-pyrrolizine-1,2-dicarboxylate
Also Known As: Bionet2_000970, dimethyl 5-phenyl-2,3-dihydro-1H-pyrrolizine-6,7-dicarboxylate, ZERO/004985, 6,7-dimethyl 5-phenyl-2,3-dihydro-1H-pyrrolizine-6,7-dicarboxylate, dimethyl 3-phenyl-6,7-dihydro-5H-pyrrolizine-1,2-dicarboxylate
| Molecular Formula | C17H17NO4 |
|---|---|
| Molecular Weight | 299.12 g/mol |
| LogP | 2.6745 |
| Topological Polar Surface Area | 57.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 299.11575 |
| Heavy Atoms | 22 |
| Complexity | 730.86237 |
Chemical Identifiers
| CAS Number | 60026-93-9 |
|---|---|
| SMILES | COC(=O)C1=C2CCCN2C(=C1C(=O)OC)C3=CC=CC=C3 |
Product Overview
dimethyl 5-phenyl-2,3-dihydro-1H-pyrrolizine-6,7-dicarboxylate (CAS 60026-93-9), with molecular formula C17H17NO4 and molecular weight 299.12 g/mol. IUPAC: dimethyl 3-phenyl-6,7-dihydro-5H-pyrrolizine-1,2-dicarboxylate.
Chemical Property Profile of dimethyl 5-phenyl-2,3-dihydro-1H-pyrrolizine-6,7-dicarboxylate
Property Insights of dimethyl 5-phenyl-2,3-dihydro-1H-pyrrolizine-6,7-dicarboxylate
The XLogP value of 2.6745 suggests moderate lipophilicity, balancing water solubility and membrane permeability for dimethyl 5-phenyl-2,3-dihydro-1H-pyrrolizine-6,7-dicarboxylate. With a topological polar surface area (TPSA) of 57.53 Ų, dimethyl 5-phenyl-2,3-dihydro-1H-pyrrolizine-6,7-dicarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, dimethyl 5-phenyl-2,3-dihydro-1H-pyrrolizine-6,7-dicarboxylate has 0 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 dimethyl 5-phenyl-2,3-dihydro-1H-pyrrolizine-6,7-dicarboxylate?
The CAS number of dimethyl 5-phenyl-2,3-dihydro-1H-pyrrolizine-6,7-dicarboxylate is 60026-93-9.
What is the molecular formula of dimethyl 5-phenyl-2,3-dihydro-1H-pyrrolizine-6,7-dicarboxylate?
The molecular formula of dimethyl 5-phenyl-2,3-dihydro-1H-pyrrolizine-6,7-dicarboxylate is C17H17NO4.
What is the molecular weight of dimethyl 5-phenyl-2,3-dihydro-1H-pyrrolizine-6,7-dicarboxylate?
The molecular weight of dimethyl 5-phenyl-2,3-dihydro-1H-pyrrolizine-6,7-dicarboxylate is 299.12 g/mol.
Where can I buy dimethyl 5-phenyl-2,3-dihydro-1H-pyrrolizine-6,7-dicarboxylate?
You can request a quote for dimethyl 5-phenyl-2,3-dihydro-1H-pyrrolizine-6,7-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for dimethyl 5-phenyl-2,3-dihydro-1H-pyrrolizine-6,7-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for dimethyl 5-phenyl-2,3-dihydro-1H-pyrrolizine-6,7-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.