CAS 139974-36-0 - C11H13N3O4
TL;DR: CAS 139974-36-0 - C11H13N3O4 (CAS 139974-36-0) is a chemical compound with molecular formula C11H13N3O4 and molecular weight 251.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,5S)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolane-2-carbonitrile
Also Known As: 2-Furancarbonitrile, 5-(3,4-dihydro-5-methyl-2,4-dioxo-1(2H)-pyrimidinyl)tetrahydro-2-(hydroxymethyl)-, (2S-trans)-
| Molecular Formula | C11H13N3O4 |
|---|---|
| Molecular Weight | 251.09 g/mol |
| LogP | -0.5913 |
| Topological Polar Surface Area | 108.11 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 251.0906 |
| Heavy Atoms | 18 |
| Complexity | 611.93994 |
Chemical Identifiers
| CAS Number | 139974-36-0 |
|---|---|
| SMILES | CC1=CN(C(=O)NC1=O)[C@@H]2CC[C@@](O2)(CO)C#N |
Product Overview
CAS 139974-36-0 - C11H13N3O4 (CAS 139974-36-0), with molecular formula C11H13N3O4 and molecular weight 251.09 g/mol. IUPAC: (2S,5S)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolane-2-carbonitrile.
Chemical Property Profile of CAS 139974-36-0 - C11H13N3O4
Property Insights of CAS 139974-36-0 - C11H13N3O4
The XLogP value of -0.5913 indicates that CAS 139974-36-0 - C11H13N3O4 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 108.11 Ų falls within the moderate polarity range, balancing permeability and solubility for CAS 139974-36-0 - C11H13N3O4. Following Lipinski's Rule of Five, CAS 139974-36-0 - C11H13N3O4 has 2 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 CAS 139974-36-0 - C11H13N3O4?
The CAS number of CAS 139974-36-0 - C11H13N3O4 is 139974-36-0.
What is the molecular formula of CAS 139974-36-0 - C11H13N3O4?
The molecular formula of CAS 139974-36-0 - C11H13N3O4 is C11H13N3O4.
What is the molecular weight of CAS 139974-36-0 - C11H13N3O4?
The molecular weight of CAS 139974-36-0 - C11H13N3O4 is 251.09 g/mol.
Where can I buy CAS 139974-36-0 - C11H13N3O4?
You can request a quote for CAS 139974-36-0 - C11H13N3O4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CAS 139974-36-0 - C11H13N3O4?
Yes, KEHONG BIO provides custom synthesis services for CAS 139974-36-0 - C11H13N3O4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.