Benzyl 2-benzamido-3-methylbutanoate
TL;DR: Benzyl 2-benzamido-3-methylbutanoate (CAS 17645-52-2) is a chemical compound with molecular formula C19H21NO3 and molecular weight 311.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 2-benzamido-3-methylbutanoate
Also Known As: benzyl 2-benzamido-3-methylbutanoate, benzyl N-(phenylcarbonyl)valinate, BENZYL 2-(BENZOYLAMINO)-3-METHYLBUTANOATE, BENZYL 3-METHYL-2-(PHENYLFORMAMIDO)BUTANOATE, phenylmethyl 3-methyl-2-(phenylcarbonylamino)butanoate
| Molecular Formula | C19H21NO3 |
|---|---|
| Molecular Weight | 311.15 g/mol |
| LogP | 3.1844 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 311.15213 |
| Heavy Atoms | 23 |
| Complexity | 638.179 |
Chemical Identifiers
| CAS Number | 17645-52-2 |
|---|---|
| SMILES | CC(C)C(C(=O)OCC1=CC=CC=C1)NC(=O)C2=CC=CC=C2 |
Product Overview
Benzyl 2-benzamido-3-methylbutanoate (CAS 17645-52-2), with molecular formula C19H21NO3 and molecular weight 311.15 g/mol. IUPAC: benzyl 2-benzamido-3-methylbutanoate.
Chemical Property Profile of Benzyl 2-benzamido-3-methylbutanoate
Property Insights of Benzyl 2-benzamido-3-methylbutanoate
The XLogP value of 3.1844 indicates that Benzyl 2-benzamido-3-methylbutanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, Benzyl 2-benzamido-3-methylbutanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyl 2-benzamido-3-methylbutanoate has 1 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 Benzyl 2-benzamido-3-methylbutanoate?
The CAS number of Benzyl 2-benzamido-3-methylbutanoate is 17645-52-2.
What is the molecular formula of Benzyl 2-benzamido-3-methylbutanoate?
The molecular formula of Benzyl 2-benzamido-3-methylbutanoate is C19H21NO3.
What is the molecular weight of Benzyl 2-benzamido-3-methylbutanoate?
The molecular weight of Benzyl 2-benzamido-3-methylbutanoate is 311.15 g/mol.
Where can I buy Benzyl 2-benzamido-3-methylbutanoate?
You can request a quote for Benzyl 2-benzamido-3-methylbutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl 2-benzamido-3-methylbutanoate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl 2-benzamido-3-methylbutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.