methyl N-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]glycinate
TL;DR: methyl N-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]glycinate (CAS 1164514-98-0) is a chemical compound with molecular formula C13H15NO4 and molecular weight 249.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]acetate
Also Known As: methyl N-[3-(4-methoxyphenyl)acryloyl]glycinate, methyl N-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]glycinate, (E)-methyl 2-(3-(4-methoxyphenyl)acrylamido)acetate, BRD-K45323345-001-03-6, methyl 2-[(2E)-3-(4-methoxyphenyl)prop-2-enoylamino]acetate
| Molecular Formula | C13H15NO4 |
|---|---|
| Molecular Weight | 249.10 g/mol |
| LogP | 0.9976 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 249.10011 |
| Heavy Atoms | 18 |
| Complexity | 436.8094 |
Chemical Identifiers
| CAS Number | 1164514-98-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)/C=C/C(=O)NCC(=O)OC |
Product Overview
methyl N-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]glycinate (CAS 1164514-98-0), with molecular formula C13H15NO4 and molecular weight 249.10 g/mol. IUPAC: methyl 2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]acetate.
Chemical Property Profile of methyl N-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]glycinate
Property Insights of methyl N-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]glycinate
The XLogP value of 0.9976 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]glycinate. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]glycinate. Following Lipinski's Rule of Five, methyl N-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]glycinate has 1 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 N-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]glycinate?
The CAS number of methyl N-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]glycinate is 1164514-98-0.
What is the molecular formula of methyl N-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]glycinate?
The molecular formula of methyl N-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]glycinate is C13H15NO4.
What is the molecular weight of methyl N-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]glycinate?
The molecular weight of methyl N-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]glycinate is 249.10 g/mol.
Where can I buy methyl N-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]glycinate?
You can request a quote for methyl N-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]glycinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl N-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]glycinate?
Yes, KEHONG BIO provides custom synthesis services for methyl N-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]glycinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.