NCI60_019820
TL;DR: NCI60_019820 (CAS 376367-95-2) is a chemical compound with molecular formula C11H13N3O5 and molecular weight 267.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2H-azirin-3-yl)-1-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
Also Known As: NCI60_019820, 5-(2H-aziren-3-yl)-1-(2-deoxypentofuranosyl)pyrimidine-2,4(1H,3H)-dione, Bis[2-(2,4-difluorophenyl)pyridine-C2,N'](acetylacetonato)iridium(III), 5-(2H-azirin-3-yl)-1-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
| Molecular Formula | C11H13N3O5 |
|---|---|
| Molecular Weight | 267.09 g/mol |
| LogP | -1.7 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 267.0855 |
| Heavy Atoms | 19 |
| Complexity | 501.0 |
Chemical Identifiers
| CAS Number | 376367-95-2 |
|---|---|
| SMILES | C1C(C(OC1N2C=C(C(=O)NC2=O)C3=NC3)CO)O |
| InChIKey | BIIZWMXEQROORM-UHFFFAOYSA-N |
Product Overview
NCI60_019820 (CAS 376367-95-2), with molecular formula C11H13N3O5 and molecular weight 267.09 g/mol. IUPAC: 5-(2H-azirin-3-yl)-1-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione.
Chemical Property Profile of NCI60_019820
Property Insights of NCI60_019820
The XLogP value of -1.7 indicates that NCI60_019820 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for NCI60_019820. Following Lipinski's Rule of Five, NCI60_019820 has 3 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 NCI60_019820?
The CAS number of NCI60_019820 is 376367-95-2.
What is the molecular formula of NCI60_019820?
The molecular formula of NCI60_019820 is C11H13N3O5.
What is the molecular weight of NCI60_019820?
The molecular weight of NCI60_019820 is 267.09 g/mol.
Where can I buy NCI60_019820?
You can request a quote for NCI60_019820 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for NCI60_019820?
Yes, KEHONG BIO provides custom synthesis services for NCI60_019820 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.