ETHYL 4-AMINO-2-(2-HYDROXY-3-METHOXY-PHENYL)-6-(4-NITROPHENYL)-1,2,5,6-TETRAHYDROPYRIDINE-3-CARBOXYLATE
TL;DR: ETHYL 4-AMINO-2-(2-HYDROXY-3-METHOXY-PHENYL)-6-(4-NITROPHENYL)-1,2,5,6-TETRAHYDROPYRIDINE-3-CARBOXYLATE (CAS 59623-98-2) is a chemical compound with molecular formula C21H23N3O6 and molecular weight 413.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-amino-6-(2-hydroxy-3-methoxyphenyl)-2-(4-nitrophenyl)-1,2,3,6-tetrahydropyridine-5-carboxylate
Also Known As: ETHYL 4-AMINO-2-(2-HYDROXY-3-METHOXY-PHENYL)-6-(4-NITROPHENYL)-1,2,5,6-TETRAHYDROPYRIDINE-3-CARBOXYLATE, ethyl 4-amino-6-(2-hydroxy-3-methoxyphenyl)-2-(4-nitrophenyl, ethyl 4-amino-6-(2-hydroxy-3-methoxyphenyl)-2-(4-nitrophenyl)-1,2,3,6-tetrahydropyridine-5-carboxylate, Ethyl 4-amino-2-(2-hydroxy-3-methoxyphenyl)-6-(4-nitrophenyl)-1,2,5,6-tetrahydropyridine-3-carboxylate
| Molecular Formula | C21H23N3O6 |
|---|---|
| Molecular Weight | 413.16 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 140.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 413.1587 |
| Heavy Atoms | 30 |
| Complexity | 656.0 |
Chemical Identifiers
| CAS Number | 59623-98-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(CC(NC1C2=C(C(=CC=C2)OC)O)C3=CC=C(C=C3)[N+](=O)[O-])N |
| InChIKey | MNCMUSWHJIXNGF-UHFFFAOYSA-N |
Product Overview
ETHYL 4-AMINO-2-(2-HYDROXY-3-METHOXY-PHENYL)-6-(4-NITROPHENYL)-1,2,5,6-TETRAHYDROPYRIDINE-3-CARBOXYLATE (CAS 59623-98-2), with molecular formula C21H23N3O6 and molecular weight 413.16 g/mol. IUPAC: ethyl 4-amino-6-(2-hydroxy-3-methoxyphenyl)-2-(4-nitrophenyl)-1,2,3,6-tetrahydropyridine-5-carboxylate.
Chemical Property Profile of ETHYL 4-AMINO-2-(2-HYDROXY-3-METHOXY-PHENYL)-6-(4-NITROPHENYL)-1,2,5,6-TETRAHYDROPYRIDINE-3-CARBOXYLATE
Property Insights of ETHYL 4-AMINO-2-(2-HYDROXY-3-METHOXY-PHENYL)-6-(4-NITROPHENYL)-1,2,5,6-TETRAHYDROPYRIDINE-3-CARBOXYLATE
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ETHYL 4-AMINO-2-(2-HYDROXY-3-METHOXY-PHENYL)-6-(4-NITROPHENYL)-1,2,5,6-TETRAHYDROPYRIDINE-3-CARBOXYLATE. The TPSA of 140.0 Ų indicates high polarity, suggesting ETHYL 4-AMINO-2-(2-HYDROXY-3-METHOXY-PHENYL)-6-(4-NITROPHENYL)-1,2,5,6-TETRAHYDROPYRIDINE-3-CARBOXYLATE may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ETHYL 4-AMINO-2-(2-HYDROXY-3-METHOXY-PHENYL)-6-(4-NITROPHENYL)-1,2,5,6-TETRAHYDROPYRIDINE-3-CARBOXYLATE has 3 hydrogen bond donor(s) and 8 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 4-AMINO-2-(2-HYDROXY-3-METHOXY-PHENYL)-6-(4-NITROPHENYL)-1,2,5,6-TETRAHYDROPYRIDINE-3-CARBOXYLATE?
The CAS number of ETHYL 4-AMINO-2-(2-HYDROXY-3-METHOXY-PHENYL)-6-(4-NITROPHENYL)-1,2,5,6-TETRAHYDROPYRIDINE-3-CARBOXYLATE is 59623-98-2.
What is the molecular formula of ETHYL 4-AMINO-2-(2-HYDROXY-3-METHOXY-PHENYL)-6-(4-NITROPHENYL)-1,2,5,6-TETRAHYDROPYRIDINE-3-CARBOXYLATE?
The molecular formula of ETHYL 4-AMINO-2-(2-HYDROXY-3-METHOXY-PHENYL)-6-(4-NITROPHENYL)-1,2,5,6-TETRAHYDROPYRIDINE-3-CARBOXYLATE is C21H23N3O6.
What is the molecular weight of ETHYL 4-AMINO-2-(2-HYDROXY-3-METHOXY-PHENYL)-6-(4-NITROPHENYL)-1,2,5,6-TETRAHYDROPYRIDINE-3-CARBOXYLATE?
The molecular weight of ETHYL 4-AMINO-2-(2-HYDROXY-3-METHOXY-PHENYL)-6-(4-NITROPHENYL)-1,2,5,6-TETRAHYDROPYRIDINE-3-CARBOXYLATE is 413.16 g/mol.
Where can I buy ETHYL 4-AMINO-2-(2-HYDROXY-3-METHOXY-PHENYL)-6-(4-NITROPHENYL)-1,2,5,6-TETRAHYDROPYRIDINE-3-CARBOXYLATE?
You can request a quote for ETHYL 4-AMINO-2-(2-HYDROXY-3-METHOXY-PHENYL)-6-(4-NITROPHENYL)-1,2,5,6-TETRAHYDROPYRIDINE-3-CARBOXYLATE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ETHYL 4-AMINO-2-(2-HYDROXY-3-METHOXY-PHENYL)-6-(4-NITROPHENYL)-1,2,5,6-TETRAHYDROPYRIDINE-3-CARBOXYLATE?
Yes, KEHONG BIO provides custom synthesis services for ETHYL 4-AMINO-2-(2-HYDROXY-3-METHOXY-PHENYL)-6-(4-NITROPHENYL)-1,2,5,6-TETRAHYDROPYRIDINE-3-CARBOXYLATE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.