![Methyl 2-[3-(phenylmethoxycarbonylamino)propanoylamino]acetate structure](/static/products/891/89137-40-6.png)
Methyl 2-[3-(phenylmethoxycarbonylamino)propanoylamino]acetate
TL;DR: Methyl 2-[3-(phenylmethoxycarbonylamino)propanoylamino]acetate (CAS 89137-40-6) is a chemical compound with molecular formula C14H18N2O5 and molecular weight 294.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[3-(phenylmethoxycarbonylamino)propanoylamino]acetate
Also Known As: methyl 2-[3-(phenylmethoxycarbonylamino)propanoylamino]acetate, Methyl N-[(benzyloxy)carbonyl]-beta-alanylglycinate, N-carbobenzyloxy-.beta.-alanyl-glycine methyl ester, methyl 2-(3-{[(benzyloxy)carbonyl]amino}propanamido)acetate, Methyl [(3-([(benzyloxy)carbonyl]amino)propanoyl)amino]acetate
| Molecular Formula | C14H18N2O5 |
|---|---|
| Molecular Weight | 294.12 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 93.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 294.12158 |
| Heavy Atoms | 21 |
| Complexity | 353.0 |
Chemical Identifiers
| CAS Number | 89137-40-6 |
|---|---|
| SMILES | COC(=O)CNC(=O)CCNC(=O)OCC1=CC=CC=C1 |
| InChIKey | SRTRHRPTDAYVJN-UHFFFAOYSA-N |
Product Overview
Methyl 2-[3-(phenylmethoxycarbonylamino)propanoylamino]acetate (CAS 89137-40-6), with molecular formula C14H18N2O5 and molecular weight 294.12 g/mol. IUPAC: methyl 2-[3-(phenylmethoxycarbonylamino)propanoylamino]acetate.
Chemical Property Profile of Methyl 2-[3-(phenylmethoxycarbonylamino)propanoylamino]acetate
Property Insights of Methyl 2-[3-(phenylmethoxycarbonylamino)propanoylamino]acetate
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-[3-(phenylmethoxycarbonylamino)propanoylamino]acetate. The TPSA of 93.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-[3-(phenylmethoxycarbonylamino)propanoylamino]acetate. Following Lipinski's Rule of Five, Methyl 2-[3-(phenylmethoxycarbonylamino)propanoylamino]acetate has 2 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 Methyl 2-[3-(phenylmethoxycarbonylamino)propanoylamino]acetate?
The CAS number of Methyl 2-[3-(phenylmethoxycarbonylamino)propanoylamino]acetate is 89137-40-6.
What is the molecular formula of Methyl 2-[3-(phenylmethoxycarbonylamino)propanoylamino]acetate?
The molecular formula of Methyl 2-[3-(phenylmethoxycarbonylamino)propanoylamino]acetate is C14H18N2O5.
What is the molecular weight of Methyl 2-[3-(phenylmethoxycarbonylamino)propanoylamino]acetate?
The molecular weight of Methyl 2-[3-(phenylmethoxycarbonylamino)propanoylamino]acetate is 294.12 g/mol.
Where can I buy Methyl 2-[3-(phenylmethoxycarbonylamino)propanoylamino]acetate?
You can request a quote for Methyl 2-[3-(phenylmethoxycarbonylamino)propanoylamino]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-[3-(phenylmethoxycarbonylamino)propanoylamino]acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[3-(phenylmethoxycarbonylamino)propanoylamino]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.