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[(4-Chlorophenyl)methylideneamino] 4-tert-butylbenzoate
TL;DR: [(4-Chlorophenyl)methylideneamino] 4-tert-butylbenzoate (CAS 331462-08-9) is a chemical compound with molecular formula C18H18ClNO2 and molecular weight 315.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(4-chlorophenyl)methylideneamino] 4-tert-butylbenzoate
Also Known As: [(4-chlorophenyl)methylideneamino] 4-tert-butylbenzoate, 1-(tert-butyl)-4-[({[(4-chlorophenyl)methylene]amino}oxy)carbonyl]benzene
| Molecular Formula | C18H18ClNO2 |
|---|---|
| Molecular Weight | 315.10 g/mol |
| LogP | 4.8284 |
| Topological Polar Surface Area | 38.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 315.1026 |
| Heavy Atoms | 22 |
| Complexity | 667.7285 |
Chemical Identifiers
| CAS Number | 331462-08-9 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)ON=CC2=CC=C(C=C2)Cl |
Product Overview
[(4-Chlorophenyl)methylideneamino] 4-tert-butylbenzoate (CAS 331462-08-9), with molecular formula C18H18ClNO2 and molecular weight 315.10 g/mol. IUPAC: [(4-chlorophenyl)methylideneamino] 4-tert-butylbenzoate.
Chemical Property Profile of [(4-Chlorophenyl)methylideneamino] 4-tert-butylbenzoate
Property Insights of [(4-Chlorophenyl)methylideneamino] 4-tert-butylbenzoate
The XLogP value of 4.8284 indicates that [(4-Chlorophenyl)methylideneamino] 4-tert-butylbenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.66 Ų, [(4-Chlorophenyl)methylideneamino] 4-tert-butylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(4-Chlorophenyl)methylideneamino] 4-tert-butylbenzoate 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 [(4-Chlorophenyl)methylideneamino] 4-tert-butylbenzoate?
The CAS number of [(4-Chlorophenyl)methylideneamino] 4-tert-butylbenzoate is 331462-08-9.
What is the molecular formula of [(4-Chlorophenyl)methylideneamino] 4-tert-butylbenzoate?
The molecular formula of [(4-Chlorophenyl)methylideneamino] 4-tert-butylbenzoate is C18H18ClNO2.
What is the molecular weight of [(4-Chlorophenyl)methylideneamino] 4-tert-butylbenzoate?
The molecular weight of [(4-Chlorophenyl)methylideneamino] 4-tert-butylbenzoate is 315.10 g/mol.
Where can I buy [(4-Chlorophenyl)methylideneamino] 4-tert-butylbenzoate?
You can request a quote for [(4-Chlorophenyl)methylideneamino] 4-tert-butylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(4-Chlorophenyl)methylideneamino] 4-tert-butylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for [(4-Chlorophenyl)methylideneamino] 4-tert-butylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.