![[[Amino(pyridin-4-yl)methylidene]amino] 3-chloro-4-methylbenzoate structure](/static/products/500/500276-98-2.png)
[[Amino(pyridin-4-yl)methylidene]amino] 3-chloro-4-methylbenzoate
TL;DR: [[Amino(pyridin-4-yl)methylidene]amino] 3-chloro-4-methylbenzoate (CAS 500276-98-2) is a chemical compound with molecular formula C14H12ClN3O2 and molecular weight 289.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[amino(pyridin-4-yl)methylidene]amino] 3-chloro-4-methylbenzoate
Also Known As: [[amino(pyridin-4-yl)methylidene]amino] 3-chloro-4-methylbenzoate
| Molecular Formula | C14H12ClN3O2 |
|---|---|
| Molecular Weight | 289.06 g/mol |
| LogP | 2.52072 |
| Topological Polar Surface Area | 77.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 289.0618 |
| Heavy Atoms | 20 |
| Complexity | 656.7235 |
Chemical Identifiers
| CAS Number | 500276-98-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)ON=C(C2=CC=NC=C2)N)Cl |
Product Overview
[[Amino(pyridin-4-yl)methylidene]amino] 3-chloro-4-methylbenzoate (CAS 500276-98-2), with molecular formula C14H12ClN3O2 and molecular weight 289.06 g/mol. IUPAC: [[amino(pyridin-4-yl)methylidene]amino] 3-chloro-4-methylbenzoate.
Chemical Property Profile of [[Amino(pyridin-4-yl)methylidene]amino] 3-chloro-4-methylbenzoate
Property Insights of [[Amino(pyridin-4-yl)methylidene]amino] 3-chloro-4-methylbenzoate
The XLogP value of 2.52072 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [[Amino(pyridin-4-yl)methylidene]amino] 3-chloro-4-methylbenzoate. The TPSA of 77.57 Ų falls within the moderate polarity range, balancing permeability and solubility for [[Amino(pyridin-4-yl)methylidene]amino] 3-chloro-4-methylbenzoate. Following Lipinski's Rule of Five, [[Amino(pyridin-4-yl)methylidene]amino] 3-chloro-4-methylbenzoate has 1 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 [[Amino(pyridin-4-yl)methylidene]amino] 3-chloro-4-methylbenzoate?
The CAS number of [[Amino(pyridin-4-yl)methylidene]amino] 3-chloro-4-methylbenzoate is 500276-98-2.
What is the molecular formula of [[Amino(pyridin-4-yl)methylidene]amino] 3-chloro-4-methylbenzoate?
The molecular formula of [[Amino(pyridin-4-yl)methylidene]amino] 3-chloro-4-methylbenzoate is C14H12ClN3O2.
What is the molecular weight of [[Amino(pyridin-4-yl)methylidene]amino] 3-chloro-4-methylbenzoate?
The molecular weight of [[Amino(pyridin-4-yl)methylidene]amino] 3-chloro-4-methylbenzoate is 289.06 g/mol.
Where can I buy [[Amino(pyridin-4-yl)methylidene]amino] 3-chloro-4-methylbenzoate?
You can request a quote for [[Amino(pyridin-4-yl)methylidene]amino] 3-chloro-4-methylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [[Amino(pyridin-4-yl)methylidene]amino] 3-chloro-4-methylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for [[Amino(pyridin-4-yl)methylidene]amino] 3-chloro-4-methylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.