1-(2-Deoxy-2-methylidenepentofuranosyl)-4-imino-1,4-dihydropyrimidin-2-ol
TL;DR: 1-(2-Deoxy-2-methylidenepentofuranosyl)-4-imino-1,4-dihydropyrimidin-2-ol (CAS 119804-96-5) is a chemical compound with molecular formula C10H13N3O4 and molecular weight 239.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-1-[(2R,5R)-4-hydroxy-5-(hydroxymethyl)-3-methylideneoxolan-2-yl]pyrimidin-2-one
Also Known As: DMDC, 2'-Deoxy-2'-methylenecytidine, 2'-Deoxy-2'-methylidenecytidine, 2'-Methyl-2'-deoxyidenecytidine, Cytidine, 2'-deoxy-2'-methylene-
| Molecular Formula | C10H13N3O4 |
|---|---|
| Molecular Weight | 239.09 g/mol |
| LogP | -2.0 |
| Topological Polar Surface Area | 108.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 239.0906 |
| Heavy Atoms | 17 |
| Complexity | 418.0 |
Chemical Identifiers
| CAS Number | 119804-96-5 |
|---|---|
| SMILES | C=C1[C@@H](O[C@@H](C1O)CO)N2C=CC(=NC2=O)N |
| InChIKey | PULHLIOPJXPGJN-CQTSCFDVSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(2-Deoxy-2-methylidenepentofuranosyl)-4-imino-1,4-dihydropyrimidin-2-ol (CAS 119804-96-5), with molecular formula C10H13N3O4 and molecular weight 239.09 g/mol. IUPAC: 4-amino-1-[(2R,5R)-4-hydroxy-5-(hydroxymethyl)-3-methylideneoxolan-2-yl]pyrimidin-2-one.
Chemical Property Profile of 1-(2-Deoxy-2-methylidenepentofuranosyl)-4-imino-1,4-dihydropyrimidin-2-ol
Property Insights of 1-(2-Deoxy-2-methylidenepentofuranosyl)-4-imino-1,4-dihydropyrimidin-2-ol
The XLogP value of -2.0 indicates that 1-(2-Deoxy-2-methylidenepentofuranosyl)-4-imino-1,4-dihydropyrimidin-2-ol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-Deoxy-2-methylidenepentofuranosyl)-4-imino-1,4-dihydropyrimidin-2-ol. Following Lipinski's Rule of Five, 1-(2-Deoxy-2-methylidenepentofuranosyl)-4-imino-1,4-dihydropyrimidin-2-ol has 3 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 1-(2-Deoxy-2-methylidenepentofuranosyl)-4-imino-1,4-dihydropyrimidin-2-ol?
The CAS number of 1-(2-Deoxy-2-methylidenepentofuranosyl)-4-imino-1,4-dihydropyrimidin-2-ol is 119804-96-5.
What is the molecular formula of 1-(2-Deoxy-2-methylidenepentofuranosyl)-4-imino-1,4-dihydropyrimidin-2-ol?
The molecular formula of 1-(2-Deoxy-2-methylidenepentofuranosyl)-4-imino-1,4-dihydropyrimidin-2-ol is C10H13N3O4.
What is the molecular weight of 1-(2-Deoxy-2-methylidenepentofuranosyl)-4-imino-1,4-dihydropyrimidin-2-ol?
The molecular weight of 1-(2-Deoxy-2-methylidenepentofuranosyl)-4-imino-1,4-dihydropyrimidin-2-ol is 239.09 g/mol.
Where can I buy 1-(2-Deoxy-2-methylidenepentofuranosyl)-4-imino-1,4-dihydropyrimidin-2-ol?
You can request a quote for 1-(2-Deoxy-2-methylidenepentofuranosyl)-4-imino-1,4-dihydropyrimidin-2-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Deoxy-2-methylidenepentofuranosyl)-4-imino-1,4-dihydropyrimidin-2-ol?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Deoxy-2-methylidenepentofuranosyl)-4-imino-1,4-dihydropyrimidin-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.