Methyl 2-(((2-benzamido-5-bromophenyl)(phenyl)methyl)amino)acetate
TL;DR: Methyl 2-(((2-benzamido-5-bromophenyl)(phenyl)methyl)amino)acetate (CAS 313648-32-7) is a chemical compound with molecular formula C23H21BrN2O3 and molecular weight 452.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[(2-benzamido-5-bromophenyl)-phenylmethyl]amino]acetate
Also Known As: BAS 00462497, methyl 2-(((2-benzamido-5-bromophenyl)(phenyl)methyl)amino)acetate, AB00091616-01, METHYL 2-{[(2-BENZAMIDO-5-BROMOPHENYL)(PHENYL)METHYL]AMINO}ACETATE, F0013-1131
| Molecular Formula | C23H21BrN2O3 |
|---|---|
| Molecular Weight | 452.07 g/mol |
| LogP | 4.5534 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 452.07355 |
| Heavy Atoms | 29 |
| Complexity | 977.9278 |
Chemical Identifiers
| CAS Number | 313648-32-7 |
|---|---|
| SMILES | COC(=O)CNC(C1=CC=CC=C1)C2=C(C=CC(=C2)Br)NC(=O)C3=CC=CC=C3 |
Product Overview
Methyl 2-(((2-benzamido-5-bromophenyl)(phenyl)methyl)amino)acetate (CAS 313648-32-7), with molecular formula C23H21BrN2O3 and molecular weight 452.07 g/mol. IUPAC: methyl 2-[[(2-benzamido-5-bromophenyl)-phenylmethyl]amino]acetate.
Chemical Property Profile of Methyl 2-(((2-benzamido-5-bromophenyl)(phenyl)methyl)amino)acetate
Property Insights of Methyl 2-(((2-benzamido-5-bromophenyl)(phenyl)methyl)amino)acetate
The XLogP value of 4.5534 indicates that Methyl 2-(((2-benzamido-5-bromophenyl)(phenyl)methyl)amino)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-(((2-benzamido-5-bromophenyl)(phenyl)methyl)amino)acetate. Following Lipinski's Rule of Five, Methyl 2-(((2-benzamido-5-bromophenyl)(phenyl)methyl)amino)acetate has 2 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 Methyl 2-(((2-benzamido-5-bromophenyl)(phenyl)methyl)amino)acetate?
The CAS number of Methyl 2-(((2-benzamido-5-bromophenyl)(phenyl)methyl)amino)acetate is 313648-32-7.
What is the molecular formula of Methyl 2-(((2-benzamido-5-bromophenyl)(phenyl)methyl)amino)acetate?
The molecular formula of Methyl 2-(((2-benzamido-5-bromophenyl)(phenyl)methyl)amino)acetate is C23H21BrN2O3.
What is the molecular weight of Methyl 2-(((2-benzamido-5-bromophenyl)(phenyl)methyl)amino)acetate?
The molecular weight of Methyl 2-(((2-benzamido-5-bromophenyl)(phenyl)methyl)amino)acetate is 452.07 g/mol.
Where can I buy Methyl 2-(((2-benzamido-5-bromophenyl)(phenyl)methyl)amino)acetate?
You can request a quote for Methyl 2-(((2-benzamido-5-bromophenyl)(phenyl)methyl)amino)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-(((2-benzamido-5-bromophenyl)(phenyl)methyl)amino)acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-(((2-benzamido-5-bromophenyl)(phenyl)methyl)amino)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.