RefChem:1068607
TL;DR: RefChem:1068607 (CAS 145163-77-5) is a chemical compound with molecular formula C16H21N3O3 and molecular weight 303.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-[(E)-methoxyiminomethyl]-3,6-dihydro-2H-pyridin-1-yl] N-[(1S)-1-phenylethyl]carbamate
Also Known As: 3-Pyridinecarboxaldehyde, 1,2,5,6-tetrahydro-1-((((1-phenylethyl)amino)carbonyl)oxy)-, 3-(O-methyloxime), (S-(E))-, [3-[(E)-methoxyiminomethyl]-5,6-dihydro-2H-pyridin-1-yl] N-(1-phenylethyl)carbamate, 5-[(methoxyimino)methyl]-1,2,3,6-tetrahydropyridin-1-yl N-[(1S)-1-phenylethyl]carbamate, 1-[[(alphaS)-alpha-Methylbenzyl]carbamoyl]oxy-1,2,5,6-tetrahydropyridine-3-carbaldehyde O-methyl oxime, RefChem:1068607
| Molecular Formula | C16H21N3O3 |
|---|---|
| Molecular Weight | 303.16 g/mol |
| LogP | 2.6531 |
| Topological Polar Surface Area | 63.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 303.1583 |
| Heavy Atoms | 22 |
| Complexity | 542.82684 |
Chemical Identifiers
| CAS Number | 145163-77-5 |
|---|---|
| SMILES | C[C@@H](C1=CC=CC=C1)NC(=O)ON2CCC=C(C2)/C=N/OC |
Product Overview
RefChem:1068607 (CAS 145163-77-5), with molecular formula C16H21N3O3 and molecular weight 303.16 g/mol. IUPAC: [5-[(E)-methoxyiminomethyl]-3,6-dihydro-2H-pyridin-1-yl] N-[(1S)-1-phenylethyl]carbamate.
Chemical Property Profile of RefChem:1068607
Property Insights of RefChem:1068607
The XLogP value of 2.6531 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1068607. The TPSA of 63.16 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1068607. Following Lipinski's Rule of Five, RefChem:1068607 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 RefChem:1068607?
The CAS number of RefChem:1068607 is 145163-77-5.
What is the molecular formula of RefChem:1068607?
The molecular formula of RefChem:1068607 is C16H21N3O3.
What is the molecular weight of RefChem:1068607?
The molecular weight of RefChem:1068607 is 303.16 g/mol.
Where can I buy RefChem:1068607?
You can request a quote for RefChem:1068607 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1068607?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1068607 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.