N-((2R-cis)-Epoxydodecenoyl)-L-proline methyl ester
TL;DR: N-((2R-cis)-Epoxydodecenoyl)-L-proline methyl ester (CAS 123889-00-9) is a chemical compound with molecular formula C18H31NO4 and molecular weight 325.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2S)-1-[(2R,3R)-3-nonyloxirane-2-carbonyl]pyrrolidine-2-carboxylate
Also Known As: N-((2R-cis)-Epoxydodecenoyl)-L-proline methyl ester, Methyl 1-(3-nonyloxirane-2-carbonyl)prolinate, L-Proline, 1-((3-nonyloxiranyl)carbonyl)-, methyl ester, (2R-cis)-, Methyl 1-[(2R,3R)-3-nonyloxirane-2-carbonyl]-L-prolinate, methyl (2S)-1-[(2R,3R)-3-nonyloxirane-2-carbonyl]pyrrolidine-2-carboxylate
| Molecular Formula | C18H31NO4 |
|---|---|
| Molecular Weight | 325.23 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 59.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 325.2253 |
| Heavy Atoms | 23 |
| Complexity | 398.0 |
Chemical Identifiers
| CAS Number | 123889-00-9 |
|---|---|
| SMILES | CCCCCCCCC[C@@H]1[C@@H](O1)C(=O)N2CCC[C@H]2C(=O)OC |
| InChIKey | YPUIRIMNIUMKHL-ARFHVFGLSA-N |
Product Overview
N-((2R-cis)-Epoxydodecenoyl)-L-proline methyl ester (CAS 123889-00-9), with molecular formula C18H31NO4 and molecular weight 325.23 g/mol. IUPAC: methyl (2S)-1-[(2R,3R)-3-nonyloxirane-2-carbonyl]pyrrolidine-2-carboxylate.
Chemical Property Profile of N-((2R-cis)-Epoxydodecenoyl)-L-proline methyl ester
Property Insights of N-((2R-cis)-Epoxydodecenoyl)-L-proline methyl ester
The XLogP value of 4.4 indicates that N-((2R-cis)-Epoxydodecenoyl)-L-proline methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.1 Ų, N-((2R-cis)-Epoxydodecenoyl)-L-proline methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-((2R-cis)-Epoxydodecenoyl)-L-proline methyl ester has 0 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 N-((2R-cis)-Epoxydodecenoyl)-L-proline methyl ester?
The CAS number of N-((2R-cis)-Epoxydodecenoyl)-L-proline methyl ester is 123889-00-9.
What is the molecular formula of N-((2R-cis)-Epoxydodecenoyl)-L-proline methyl ester?
The molecular formula of N-((2R-cis)-Epoxydodecenoyl)-L-proline methyl ester is C18H31NO4.
What is the molecular weight of N-((2R-cis)-Epoxydodecenoyl)-L-proline methyl ester?
The molecular weight of N-((2R-cis)-Epoxydodecenoyl)-L-proline methyl ester is 325.23 g/mol.
Where can I buy N-((2R-cis)-Epoxydodecenoyl)-L-proline methyl ester?
You can request a quote for N-((2R-cis)-Epoxydodecenoyl)-L-proline 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-((2R-cis)-Epoxydodecenoyl)-L-proline methyl ester?
Yes, KEHONG BIO provides custom synthesis services for N-((2R-cis)-Epoxydodecenoyl)-L-proline methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.