URACIL DER.
TL;DR: URACIL DER. (CAS 172256-07-4) is a chemical compound with molecular formula C17H22N2O3Se and molecular weight 382.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(ethoxymethyl)-6-(3-methylphenyl)selanyl-5-propan-2-ylpyrimidine-2,4-dione
Also Known As: URACIL DER., 2,4(1H,3H)-Pyrimidinedione, 1-(ethoxymethyl)-5-(1-methylethyl)-6-((3-methylphenyl)seleno)-, 1-Ethoxymethyl-6-((3-methylphenyl)selenenyl)-2-thioxo-5-methylethyluracil, 2,4(1H,3H)-Pyrimidinedione,1-(ethoxymethyl)-5-(1-methylethyl)-6-[(3-methylphenyl)seleno]-, 1-(ethoxymethyl)-5-isopropyl-6-(m-tolylselanyl)pyrimidine-2,4-dione
| Molecular Formula | C17H22N2O3Se |
|---|---|
| Molecular Weight | 382.08 g/mol |
| LogP | 0.61742 |
| Topological Polar Surface Area | 58.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 382.07956 |
| Heavy Atoms | 23 |
| Complexity | 490.0 |
Chemical Identifiers
| CAS Number | 172256-07-4 |
|---|---|
| SMILES | CCOCN1C(=C(C(=O)NC1=O)C(C)C)[Se]C2=CC=CC(=C2)C |
| InChIKey | WVTRASIOGMYRGQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
URACIL DER. (CAS 172256-07-4), with molecular formula C17H22N2O3Se and molecular weight 382.08 g/mol. IUPAC: 1-(ethoxymethyl)-6-(3-methylphenyl)selanyl-5-propan-2-ylpyrimidine-2,4-dione.
Chemical Property Profile of URACIL DER.
Property Insights of URACIL DER.
The XLogP value of 0.61742 suggests moderate lipophilicity, balancing water solubility and membrane permeability for URACIL DER.. With a topological polar surface area (TPSA) of 58.6 Ų, URACIL DER. exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, URACIL DER. has 1 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 URACIL DER.?
The CAS number of URACIL DER. is 172256-07-4.
What is the molecular formula of URACIL DER.?
The molecular formula of URACIL DER. is C17H22N2O3Se.
What is the molecular weight of URACIL DER.?
The molecular weight of URACIL DER. is 382.08 g/mol.
Where can I buy URACIL DER.?
You can request a quote for URACIL DER. directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for URACIL DER.?
Yes, KEHONG BIO provides custom synthesis services for URACIL DER. and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.