5-Cyclopropyl-1-ethoxymethyl-6-(phenythio)uracil
TL;DR: 5-Cyclopropyl-1-ethoxymethyl-6-(phenythio)uracil (CAS 136160-36-6) is a chemical compound with molecular formula C16H18N2O3S and molecular weight 318.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-cyclopropyl-1-(ethoxymethyl)-6-phenylsulfanylpyrimidine-2,4-dione
Also Known As: HEPT deriv., 1-EtOMe-6PhS-5cyPr U, 5-Cyclopropyl-1-ethoxymethyl-6-(phenythio)uracil, 1-[Ethoxymethyl]-5-cyclopropyl-6-(phenylthio)uracil, 5-cyclopropyl-1-(ethoxymethyl)-6-phenylsulfanylpyrimidine-2,4-dione
| Molecular Formula | C16H18N2O3S |
|---|---|
| Molecular Weight | 318.10 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 83.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 318.10382 |
| Heavy Atoms | 22 |
| Complexity | 482.0 |
Chemical Identifiers
| CAS Number | 136160-36-6 |
|---|---|
| SMILES | CCOCN1C(=C(C(=O)NC1=O)C2CC2)SC3=CC=CC=C3 |
| InChIKey | VHZHYYARALVRLG-UHFFFAOYSA-N |
Product Overview
5-Cyclopropyl-1-ethoxymethyl-6-(phenythio)uracil (CAS 136160-36-6), with molecular formula C16H18N2O3S and molecular weight 318.10 g/mol. IUPAC: 5-cyclopropyl-1-(ethoxymethyl)-6-phenylsulfanylpyrimidine-2,4-dione.
Chemical Property Profile of 5-Cyclopropyl-1-ethoxymethyl-6-(phenythio)uracil
Property Insights of 5-Cyclopropyl-1-ethoxymethyl-6-(phenythio)uracil
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Cyclopropyl-1-ethoxymethyl-6-(phenythio)uracil. The TPSA of 83.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Cyclopropyl-1-ethoxymethyl-6-(phenythio)uracil. Following Lipinski's Rule of Five, 5-Cyclopropyl-1-ethoxymethyl-6-(phenythio)uracil has 1 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 5-Cyclopropyl-1-ethoxymethyl-6-(phenythio)uracil?
The CAS number of 5-Cyclopropyl-1-ethoxymethyl-6-(phenythio)uracil is 136160-36-6.
What is the molecular formula of 5-Cyclopropyl-1-ethoxymethyl-6-(phenythio)uracil?
The molecular formula of 5-Cyclopropyl-1-ethoxymethyl-6-(phenythio)uracil is C16H18N2O3S.
What is the molecular weight of 5-Cyclopropyl-1-ethoxymethyl-6-(phenythio)uracil?
The molecular weight of 5-Cyclopropyl-1-ethoxymethyl-6-(phenythio)uracil is 318.10 g/mol.
Where can I buy 5-Cyclopropyl-1-ethoxymethyl-6-(phenythio)uracil?
You can request a quote for 5-Cyclopropyl-1-ethoxymethyl-6-(phenythio)uracil directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Cyclopropyl-1-ethoxymethyl-6-(phenythio)uracil?
Yes, KEHONG BIO provides custom synthesis services for 5-Cyclopropyl-1-ethoxymethyl-6-(phenythio)uracil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.