Methyl 3-methyl-2-(3-phenylpropylcarbamoylamino)pentanoate
TL;DR: Methyl 3-methyl-2-(3-phenylpropylcarbamoylamino)pentanoate (CAS 958952-77-7) is a chemical compound with molecular formula C17H26N2O3 and molecular weight 306.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-methyl-2-(3-phenylpropylcarbamoylamino)pentanoate
Also Known As: methyl 3-methyl-2-(3-phenylpropylcarbamoylamino)pentanoate, (2S)-methyl 3-methyl-2-(3-(3-phenylpropyl)ureido)pentanoate
| Molecular Formula | C17H26N2O3 |
|---|---|
| Molecular Weight | 306.19 g/mol |
| LogP | 2.5061 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 306.19434 |
| Heavy Atoms | 22 |
| Complexity | 462.23166 |
Chemical Identifiers
| CAS Number | 958952-77-7 |
|---|---|
| SMILES | CCC(C)C(C(=O)OC)NC(=O)NCCCC1=CC=CC=C1 |
Product Overview
Methyl 3-methyl-2-(3-phenylpropylcarbamoylamino)pentanoate (CAS 958952-77-7), with molecular formula C17H26N2O3 and molecular weight 306.19 g/mol. IUPAC: methyl 3-methyl-2-(3-phenylpropylcarbamoylamino)pentanoate.
Chemical Property Profile of Methyl 3-methyl-2-(3-phenylpropylcarbamoylamino)pentanoate
Property Insights of Methyl 3-methyl-2-(3-phenylpropylcarbamoylamino)pentanoate
The XLogP value of 2.5061 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-methyl-2-(3-phenylpropylcarbamoylamino)pentanoate. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-methyl-2-(3-phenylpropylcarbamoylamino)pentanoate. Following Lipinski's Rule of Five, Methyl 3-methyl-2-(3-phenylpropylcarbamoylamino)pentanoate has 2 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 Methyl 3-methyl-2-(3-phenylpropylcarbamoylamino)pentanoate?
The CAS number of Methyl 3-methyl-2-(3-phenylpropylcarbamoylamino)pentanoate is 958952-77-7.
What is the molecular formula of Methyl 3-methyl-2-(3-phenylpropylcarbamoylamino)pentanoate?
The molecular formula of Methyl 3-methyl-2-(3-phenylpropylcarbamoylamino)pentanoate is C17H26N2O3.
What is the molecular weight of Methyl 3-methyl-2-(3-phenylpropylcarbamoylamino)pentanoate?
The molecular weight of Methyl 3-methyl-2-(3-phenylpropylcarbamoylamino)pentanoate is 306.19 g/mol.
Where can I buy Methyl 3-methyl-2-(3-phenylpropylcarbamoylamino)pentanoate?
You can request a quote for Methyl 3-methyl-2-(3-phenylpropylcarbamoylamino)pentanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-methyl-2-(3-phenylpropylcarbamoylamino)pentanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-methyl-2-(3-phenylpropylcarbamoylamino)pentanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.