N-cinnamoyl-d-leucine methyl ester
TL;DR: N-cinnamoyl-d-leucine methyl ester (CAS 127852-94-2) is a chemical compound with molecular formula C16H21NO3 and molecular weight 275.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2R)-4-methyl-2-(3-phenylprop-2-enoylamino)pentanoate
Also Known As: N-cinnamoyl-d-leucine methyl ester, trans-N-Cinnamoyl-D-leucine methyl ester, (E)-N-(1-Oxo-3-phenyl-2-propenyl)-D-leucine methyl ester, D-Leucine, N-(1-oxo-3-phenyl-2-propenyl)-, methyl ester, (E)-
| Molecular Formula | C16H21NO3 |
|---|---|
| Molecular Weight | 275.15 g/mol |
| LogP | 2.4037 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 275.15213 |
| Heavy Atoms | 20 |
| Complexity | 465.87015 |
Chemical Identifiers
| CAS Number | 127852-94-2 |
|---|---|
| SMILES | CC(C)C[C@H](C(=O)OC)NC(=O)C=CC1=CC=CC=C1 |
Product Overview
N-cinnamoyl-d-leucine methyl ester (CAS 127852-94-2), with molecular formula C16H21NO3 and molecular weight 275.15 g/mol. IUPAC: methyl (2R)-4-methyl-2-(3-phenylprop-2-enoylamino)pentanoate.
Chemical Property Profile of N-cinnamoyl-d-leucine methyl ester
Property Insights of N-cinnamoyl-d-leucine methyl ester
The XLogP value of 2.4037 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-cinnamoyl-d-leucine methyl ester. With a topological polar surface area (TPSA) of 55.4 Ų, N-cinnamoyl-d-leucine methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-cinnamoyl-d-leucine methyl ester 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 N-cinnamoyl-d-leucine methyl ester?
The CAS number of N-cinnamoyl-d-leucine methyl ester is 127852-94-2.
What is the molecular formula of N-cinnamoyl-d-leucine methyl ester?
The molecular formula of N-cinnamoyl-d-leucine methyl ester is C16H21NO3.
What is the molecular weight of N-cinnamoyl-d-leucine methyl ester?
The molecular weight of N-cinnamoyl-d-leucine methyl ester is 275.15 g/mol.
Where can I buy N-cinnamoyl-d-leucine methyl ester?
You can request a quote for N-cinnamoyl-d-leucine methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-cinnamoyl-d-leucine methyl ester?
Yes, KEHONG BIO provides custom synthesis services for N-cinnamoyl-d-leucine methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.