RefChem:1051419
TL;DR: RefChem:1051419 (CAS 145071-47-2) is a chemical compound with molecular formula C14H15N3O5 and molecular weight 305.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-nitrophenyl) 5-[(E)-methoxyiminomethyl]-3,6-dihydro-2H-pyridine-1-carboxylate
Also Known As: 1(2H)-Pyridinecarboxylic acid, 3,6-dihydro-5-((methoxyimino)methyl)-, 4-nitrophenyl ester, (E)-, 4-Nitrophenyl (E)-3,6-dihydro-5-((methoxyimino)methyl)-1(2H)-pyridinecarboxylate, 1,2,5,6-Tetrahydro-3-methoxyiminomethyl-1-pyridinecarboxylic acid 4-nitrophenyl ester, 4-nitrophenyl 5-[(methoxyimino)methyl]-1,2,3,6-tetrahydropyridine-1-carboxylate, RefChem:1051419
| Molecular Formula | C14H15N3O5 |
|---|---|
| Molecular Weight | 305.10 g/mol |
| LogP | 2.3579 |
| Topological Polar Surface Area | 94.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 305.10117 |
| Heavy Atoms | 22 |
| Complexity | 609.40924 |
Chemical Identifiers
| CAS Number | 145071-47-2 |
|---|---|
| SMILES | CO/N=C/C1=CCCN(C1)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
RefChem:1051419 (CAS 145071-47-2), with molecular formula C14H15N3O5 and molecular weight 305.10 g/mol. IUPAC: (4-nitrophenyl) 5-[(E)-methoxyiminomethyl]-3,6-dihydro-2H-pyridine-1-carboxylate.
Chemical Property Profile of RefChem:1051419
Property Insights of RefChem:1051419
The XLogP value of 2.3579 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1051419. The TPSA of 94.27 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1051419. Following Lipinski's Rule of Five, RefChem:1051419 has 0 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 RefChem:1051419?
The CAS number of RefChem:1051419 is 145071-47-2.
What is the molecular formula of RefChem:1051419?
The molecular formula of RefChem:1051419 is C14H15N3O5.
What is the molecular weight of RefChem:1051419?
The molecular weight of RefChem:1051419 is 305.10 g/mol.
Where can I buy RefChem:1051419?
You can request a quote for RefChem:1051419 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1051419?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1051419 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.