![4-amino-1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrothiophen-2-yl]pyrimidin-2-one structure](/static/products/1733/173398-57-7.webp)
4-amino-1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrothiophen-2-yl]pyrimidin-2-one
TL;DR: 4-amino-1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrothiophen-2-yl]pyrimidin-2-one (CAS 173398-57-7) is a chemical compound with molecular formula C9H11N3O2S and molecular weight 225.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrothiophen-2-yl]pyrimidin-2-one
Also Known As: d4C, thiophene analog, 2',3'-Didehydro-2',3'-dideoxy-4'-thioCytidine, cytidine, 2',3'-didehydro-2',3'-dideoxy-4'-thio-, .beta.-D-2',3'-Didehydro-2',3'-dideoxy-4'-thiocytidine, 4-amino-1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrothiophen-2-yl]pyrimidin-2-one
| Molecular Formula | C9H11N3O2S |
|---|---|
| Molecular Weight | 225.06 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 225.0572 |
| Heavy Atoms | 15 |
| Complexity | 364.0 |
Chemical Identifiers
| CAS Number | 173398-57-7 |
|---|---|
| SMILES | C1=C[C@@H](S[C@@H]1CO)N2C=CC(=NC2=O)N |
| InChIKey | FPZVDNBKSQOYAX-POYBYMJQSA-N |
Product Overview
4-amino-1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrothiophen-2-yl]pyrimidin-2-one (CAS 173398-57-7), with molecular formula C9H11N3O2S and molecular weight 225.06 g/mol. IUPAC: 4-amino-1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrothiophen-2-yl]pyrimidin-2-one.
Chemical Property Profile of 4-amino-1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrothiophen-2-yl]pyrimidin-2-one
Property Insights of 4-amino-1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrothiophen-2-yl]pyrimidin-2-one
The XLogP value of -0.8 indicates that 4-amino-1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrothiophen-2-yl]pyrimidin-2-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-amino-1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrothiophen-2-yl]pyrimidin-2-one. Following Lipinski's Rule of Five, 4-amino-1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrothiophen-2-yl]pyrimidin-2-one has 2 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 4-amino-1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrothiophen-2-yl]pyrimidin-2-one?
The CAS number of 4-amino-1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrothiophen-2-yl]pyrimidin-2-one is 173398-57-7.
What is the molecular formula of 4-amino-1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrothiophen-2-yl]pyrimidin-2-one?
The molecular formula of 4-amino-1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrothiophen-2-yl]pyrimidin-2-one is C9H11N3O2S.
What is the molecular weight of 4-amino-1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrothiophen-2-yl]pyrimidin-2-one?
The molecular weight of 4-amino-1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrothiophen-2-yl]pyrimidin-2-one is 225.06 g/mol.
Where can I buy 4-amino-1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrothiophen-2-yl]pyrimidin-2-one?
You can request a quote for 4-amino-1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrothiophen-2-yl]pyrimidin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-amino-1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrothiophen-2-yl]pyrimidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4-amino-1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrothiophen-2-yl]pyrimidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.