(4-Methoxyphenyl)(phenyl)methyl 4-nitrobenzoate
TL;DR: (4-Methoxyphenyl)(phenyl)methyl 4-nitrobenzoate (CAS 32353-14-3) is a chemical compound with molecular formula C21H17NO5 and molecular weight 363.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(4-methoxyphenyl)-phenylmethyl] 4-nitrobenzoate
Also Known As: (4-methoxyphenyl)(phenyl)methyl 4-nitrobenzoate, KST-1A3820, 4-Methoxy-diphenylmethyl-p-nitro-benzoat, [(4-methoxyphenyl)-phenylmethyl] 4-nitrobenzoate
| Molecular Formula | C21H17NO5 |
|---|---|
| Molecular Weight | 363.11 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 81.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 363.1107 |
| Heavy Atoms | 27 |
| Complexity | 483.0 |
Chemical Identifiers
| CAS Number | 32353-14-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | VLMKZMQJNMVWEN-UHFFFAOYSA-N |
Product Overview
(4-Methoxyphenyl)(phenyl)methyl 4-nitrobenzoate (CAS 32353-14-3), with molecular formula C21H17NO5 and molecular weight 363.11 g/mol. IUPAC: [(4-methoxyphenyl)-phenylmethyl] 4-nitrobenzoate.
Chemical Property Profile of (4-Methoxyphenyl)(phenyl)methyl 4-nitrobenzoate
Property Insights of (4-Methoxyphenyl)(phenyl)methyl 4-nitrobenzoate
The XLogP value of 4.8 indicates that (4-Methoxyphenyl)(phenyl)methyl 4-nitrobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-Methoxyphenyl)(phenyl)methyl 4-nitrobenzoate. Following Lipinski's Rule of Five, (4-Methoxyphenyl)(phenyl)methyl 4-nitrobenzoate has 0 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 (4-Methoxyphenyl)(phenyl)methyl 4-nitrobenzoate?
The CAS number of (4-Methoxyphenyl)(phenyl)methyl 4-nitrobenzoate is 32353-14-3.
What is the molecular formula of (4-Methoxyphenyl)(phenyl)methyl 4-nitrobenzoate?
The molecular formula of (4-Methoxyphenyl)(phenyl)methyl 4-nitrobenzoate is C21H17NO5.
What is the molecular weight of (4-Methoxyphenyl)(phenyl)methyl 4-nitrobenzoate?
The molecular weight of (4-Methoxyphenyl)(phenyl)methyl 4-nitrobenzoate is 363.11 g/mol.
Where can I buy (4-Methoxyphenyl)(phenyl)methyl 4-nitrobenzoate?
You can request a quote for (4-Methoxyphenyl)(phenyl)methyl 4-nitrobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Methoxyphenyl)(phenyl)methyl 4-nitrobenzoate?
Yes, KEHONG BIO provides custom synthesis services for (4-Methoxyphenyl)(phenyl)methyl 4-nitrobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.