Thiophene,3-oxiranyl
TL;DR: Thiophene,3-oxiranyl (CAS 682771-51-3) is a chemical compound with molecular formula C9H18N2O4 and molecular weight 218.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[(2R,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)piperidin-2-yl]methyl]acetamide
Also Known As: Thiophene,3-oxiranyl, N-[[(2R,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)piperidin-2-yl]methyl]acetamide, N-[[(2R,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-piperidyl]methyl]acetamide, N-{[(2R,3R,4R,5R)-3,4-DIHYDROXY-5-(HYDROXYMETHYL)PIPERIDIN-2-YL]METHYL}ACETAMIDE, Acetamide, N-[[(2R,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-piperidinyl]methyl]- (9CI)
| Molecular Formula | C9H18N2O4 |
|---|---|
| Molecular Weight | 218.13 g/mol |
| LogP | -2.5754 |
| Topological Polar Surface Area | 101.82 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 218.12666 |
| Heavy Atoms | 15 |
| Complexity | 224.15788 |
Chemical Identifiers
| CAS Number | 682771-51-3 |
|---|---|
| SMILES | CC(=O)NC[C@@H]1[C@H]([C@@H]([C@H](CN1)CO)O)O |
Product Overview
Thiophene,3-oxiranyl (CAS 682771-51-3), with molecular formula C9H18N2O4 and molecular weight 218.13 g/mol. IUPAC: N-[[(2R,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)piperidin-2-yl]methyl]acetamide.
Chemical Property Profile of Thiophene,3-oxiranyl
Property Insights of Thiophene,3-oxiranyl
The XLogP value of -2.5754 indicates that Thiophene,3-oxiranyl is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 101.82 Ų falls within the moderate polarity range, balancing permeability and solubility for Thiophene,3-oxiranyl. Following Lipinski's Rule of Five, Thiophene,3-oxiranyl has 5 hydrogen bond donor(s) and 5 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 Thiophene,3-oxiranyl?
The CAS number of Thiophene,3-oxiranyl is 682771-51-3.
What is the molecular formula of Thiophene,3-oxiranyl?
The molecular formula of Thiophene,3-oxiranyl is C9H18N2O4.
What is the molecular weight of Thiophene,3-oxiranyl?
The molecular weight of Thiophene,3-oxiranyl is 218.13 g/mol.
Where can I buy Thiophene,3-oxiranyl?
You can request a quote for Thiophene,3-oxiranyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiophene,3-oxiranyl?
Yes, KEHONG BIO provides custom synthesis services for Thiophene,3-oxiranyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.