RefChem:266814
TL;DR: RefChem:266814 (CAS 98674-78-3) is a chemical compound with molecular formula C15H22N2O5 and molecular weight 310.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5S)-5-methyl-1-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidin-2-one;oxalic acid
Also Known As: 2-Pyrrolidinone, 1-(1-methyl-4-(1-pyrrolidinyl)-2-butynyl)-, (S)-, ethanedioate (1:1), (S)-N-(4-Pyrrolidino-2-butynyl)-5-methyl-2-pyrrolidone oxalate, (S)-1-(1-Methyl-4-(1-pyrrolidinyl)-2-butynyl)-2-pyrrolidinone ethanedioate (1:1), (5S)-5-methyl-1-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidin-2-one; oxalic acid, Oxalic acid--(5S)-5-methyl-1-[4-(pyrrolidin-1-yl)but-2-yn-1-yl]pyrrolidin-2-one (1/1)
| Molecular Formula | C15H22N2O5 |
|---|---|
| Molecular Weight | 310.15 g/mol |
| LogP | 0.2521 |
| Topological Polar Surface Area | 98.15 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 310.15286 |
| Heavy Atoms | 22 |
| Complexity | 462.0598 |
Chemical Identifiers
| CAS Number | 98674-78-3 |
|---|---|
| SMILES | C[C@H]1CCC(=O)N1CC#CCN2CCCC2.C(=O)(C(=O)O)O |
Product Overview
RefChem:266814 (CAS 98674-78-3), with molecular formula C15H22N2O5 and molecular weight 310.15 g/mol. IUPAC: (5S)-5-methyl-1-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidin-2-one;oxalic acid.
Chemical Property Profile of RefChem:266814
Property Insights of RefChem:266814
The XLogP value of 0.2521 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:266814. The TPSA of 98.15 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:266814. Following Lipinski's Rule of Five, RefChem:266814 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 RefChem:266814?
The CAS number of RefChem:266814 is 98674-78-3.
What is the molecular formula of RefChem:266814?
The molecular formula of RefChem:266814 is C15H22N2O5.
What is the molecular weight of RefChem:266814?
The molecular weight of RefChem:266814 is 310.15 g/mol.
Where can I buy RefChem:266814?
You can request a quote for RefChem:266814 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:266814?
Yes, KEHONG BIO provides custom synthesis services for RefChem:266814 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.