methyl N-[(furan-2-ylmethyl)carbamoyl]-D-phenylalaninate
TL;DR: methyl N-[(furan-2-ylmethyl)carbamoyl]-D-phenylalaninate (CAS 956683-83-3) is a chemical compound with molecular formula C16H18N2O4 and molecular weight 302.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2R)-2-(furan-2-ylmethylcarbamoylamino)-3-phenylpropanoate
Also Known As: methyl N-[(furan-2-ylmethyl)carbamoyl]-D-phenylalaninate, (R)-methyl 2-(3-(furan-2-ylmethyl)ureido)-3-phenylpropanoate, methyl (2R)-2-(furan-2-ylmethylcarbamoylamino)-3-phenylpropanoate
| Molecular Formula | C16H18N2O4 |
|---|---|
| Molecular Weight | 302.13 g/mol |
| LogP | 1.8631 |
| Topological Polar Surface Area | 80.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 302.12665 |
| Heavy Atoms | 22 |
| Complexity | 595.87305 |
Chemical Identifiers
| CAS Number | 956683-83-3 |
|---|---|
| SMILES | COC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)NCC2=CC=CO2 |
Product Overview
methyl N-[(furan-2-ylmethyl)carbamoyl]-D-phenylalaninate (CAS 956683-83-3), with molecular formula C16H18N2O4 and molecular weight 302.13 g/mol. IUPAC: methyl (2R)-2-(furan-2-ylmethylcarbamoylamino)-3-phenylpropanoate.
Chemical Property Profile of methyl N-[(furan-2-ylmethyl)carbamoyl]-D-phenylalaninate
Property Insights of methyl N-[(furan-2-ylmethyl)carbamoyl]-D-phenylalaninate
The XLogP value of 1.8631 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-[(furan-2-ylmethyl)carbamoyl]-D-phenylalaninate. The TPSA of 80.57 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-[(furan-2-ylmethyl)carbamoyl]-D-phenylalaninate. Following Lipinski's Rule of Five, methyl N-[(furan-2-ylmethyl)carbamoyl]-D-phenylalaninate 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 N-[(furan-2-ylmethyl)carbamoyl]-D-phenylalaninate?
The CAS number of methyl N-[(furan-2-ylmethyl)carbamoyl]-D-phenylalaninate is 956683-83-3.
What is the molecular formula of methyl N-[(furan-2-ylmethyl)carbamoyl]-D-phenylalaninate?
The molecular formula of methyl N-[(furan-2-ylmethyl)carbamoyl]-D-phenylalaninate is C16H18N2O4.
What is the molecular weight of methyl N-[(furan-2-ylmethyl)carbamoyl]-D-phenylalaninate?
The molecular weight of methyl N-[(furan-2-ylmethyl)carbamoyl]-D-phenylalaninate is 302.13 g/mol.
Where can I buy methyl N-[(furan-2-ylmethyl)carbamoyl]-D-phenylalaninate?
You can request a quote for methyl N-[(furan-2-ylmethyl)carbamoyl]-D-phenylalaninate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl N-[(furan-2-ylmethyl)carbamoyl]-D-phenylalaninate?
Yes, KEHONG BIO provides custom synthesis services for methyl N-[(furan-2-ylmethyl)carbamoyl]-D-phenylalaninate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.