methyl 4-chloro-N-(3-pyridinyl)benzenecarboximidoate
TL;DR: methyl 4-chloro-N-(3-pyridinyl)benzenecarboximidoate (CAS 75896-93-4) is a chemical compound with molecular formula C13H11ClN2O and molecular weight 246.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-chloro-N-pyridin-3-ylbenzenecarboximidate
Also Known As: methyl 4-chloro-N-(3-pyridinyl)benzenecarboximidoate, methyl 4-chloro-N-pyridin-3-ylbenzenecarboximidate, (Z)-(methyl 4-chloro-N-(pyridin-3-yl)benzene-1-carboximidate), 1-(4-chlorophenyl)-1-methoxy-N-pyridin-3-yl-methanimine, (Z)-(methyl4-chloro-N-(pyridin-3-yl)benzene-1-carboximidate)
| Molecular Formula | C13H11ClN2O |
|---|---|
| Molecular Weight | 246.06 g/mol |
| LogP | 3.4597 |
| Topological Polar Surface Area | 34.48 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 246.05598 |
| Heavy Atoms | 17 |
| Complexity | 508.70248 |
Chemical Identifiers
| CAS Number | 75896-93-4 |
|---|---|
| SMILES | COC(=NC1=CN=CC=C1)C2=CC=C(C=C2)Cl |
Product Overview
methyl 4-chloro-N-(3-pyridinyl)benzenecarboximidoate (CAS 75896-93-4), with molecular formula C13H11ClN2O and molecular weight 246.06 g/mol. IUPAC: methyl 4-chloro-N-pyridin-3-ylbenzenecarboximidate.
Chemical Property Profile of methyl 4-chloro-N-(3-pyridinyl)benzenecarboximidoate
Property Insights of methyl 4-chloro-N-(3-pyridinyl)benzenecarboximidoate
The XLogP value of 3.4597 indicates that methyl 4-chloro-N-(3-pyridinyl)benzenecarboximidoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.48 Ų, methyl 4-chloro-N-(3-pyridinyl)benzenecarboximidoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl 4-chloro-N-(3-pyridinyl)benzenecarboximidoate has 0 hydrogen bond donor(s) and 3 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 methyl 4-chloro-N-(3-pyridinyl)benzenecarboximidoate?
The CAS number of methyl 4-chloro-N-(3-pyridinyl)benzenecarboximidoate is 75896-93-4.
What is the molecular formula of methyl 4-chloro-N-(3-pyridinyl)benzenecarboximidoate?
The molecular formula of methyl 4-chloro-N-(3-pyridinyl)benzenecarboximidoate is C13H11ClN2O.
What is the molecular weight of methyl 4-chloro-N-(3-pyridinyl)benzenecarboximidoate?
The molecular weight of methyl 4-chloro-N-(3-pyridinyl)benzenecarboximidoate is 246.06 g/mol.
Where can I buy methyl 4-chloro-N-(3-pyridinyl)benzenecarboximidoate?
You can request a quote for methyl 4-chloro-N-(3-pyridinyl)benzenecarboximidoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 4-chloro-N-(3-pyridinyl)benzenecarboximidoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 4-chloro-N-(3-pyridinyl)benzenecarboximidoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.