Einecs 256-887-1
TL;DR: Einecs 256-887-1 (CAS 50980-81-9) is a chemical compound with molecular formula C24H45N5O6 and molecular weight 499.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2S)-5-(diaminomethylideneamino)-2-(dodecanoylamino)pentanoate;5-oxopyrrolidine-2-carboxylic acid
Also Known As: EINECS 256-887-1, 5-Oxo-DL-proline, compound with methyl N2-lauroyl-L-argininate (1:1), 5-Oxo-L-proline, compound with methyl N-lauroyl-L-argininate (1:1), DL-Proline, 5-oxo-, compd. with N2-(1-oxododecyl)-L-argininemethyl ester (1:1), 5-Hydroxy-3,4-dihydro-2H-pyrrole-2-carboxylic acid--N-(5-carbamimidamido-1-methoxy-1-oxopentan-2-yl)dodecanimidic acid (1/1)
| Molecular Formula | C24H45N5O6 |
|---|---|
| Molecular Weight | 499.34 g/mol |
| LogP | 1.9683 |
| Topological Polar Surface Area | 186.2 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 17 |
| Exact Mass | 499.33698 |
| Heavy Atoms | 35 |
| Complexity | 666.79016 |
Chemical Identifiers
| CAS Number | 50980-81-9 |
|---|---|
| SMILES | CCCCCCCCCCCC(=O)N[C@@H](CCCN=C(N)N)C(=O)OC.C1CC(=O)NC1C(=O)O |
Product Overview
Einecs 256-887-1 (CAS 50980-81-9), with molecular formula C24H45N5O6 and molecular weight 499.34 g/mol. IUPAC: methyl (2S)-5-(diaminomethylideneamino)-2-(dodecanoylamino)pentanoate;5-oxopyrrolidine-2-carboxylic acid.
Chemical Property Profile of Einecs 256-887-1
Property Insights of Einecs 256-887-1
The XLogP value of 1.9683 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Einecs 256-887-1. The TPSA of 186.2 Ų indicates high polarity, suggesting Einecs 256-887-1 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Einecs 256-887-1 has 5 hydrogen bond donor(s) and 6 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 Einecs 256-887-1?
The CAS number of Einecs 256-887-1 is 50980-81-9.
What is the molecular formula of Einecs 256-887-1?
The molecular formula of Einecs 256-887-1 is C24H45N5O6.
What is the molecular weight of Einecs 256-887-1?
The molecular weight of Einecs 256-887-1 is 499.34 g/mol.
Where can I buy Einecs 256-887-1?
You can request a quote for Einecs 256-887-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Einecs 256-887-1?
Yes, KEHONG BIO provides custom synthesis services for Einecs 256-887-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.