Prop-2-ynyl (Z)-3-(carbamoylcarbamoyl)prop-2-enoate
TL;DR: Prop-2-ynyl (Z)-3-(carbamoylcarbamoyl)prop-2-enoate (CAS 92303-86-1) is a chemical compound with molecular formula C8H8N2O4 and molecular weight 196.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
prop-2-ynyl 4-(carbamoylamino)-4-oxobut-2-enoate
Also Known As: prop-2-ynyl 4-(carbamoylamino)-4-oxobut-2-enoate, 5-methyl-3,6,8-trioxa-bicyclo[3.2.1]octane, prop-2-yn-1-yl 4-(carbamoylamino)-4-oxobut-2-enoate, PROP-2-YNYL (Z)-3-(CARBAMOYLCARBAMOYL)PROP-2-ENOATE
| Molecular Formula | C8H8N2O4 |
|---|---|
| Molecular Weight | 196.05 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 98.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 196.0484 |
| Heavy Atoms | 14 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 92303-86-1 |
|---|---|
| SMILES | C#CCOC(=O)C=CC(=O)NC(=O)N |
| InChIKey | YRNVCMFRLJCGOO-UHFFFAOYSA-N |
Product Overview
Prop-2-ynyl (Z)-3-(carbamoylcarbamoyl)prop-2-enoate (CAS 92303-86-1), with molecular formula C8H8N2O4 and molecular weight 196.05 g/mol. IUPAC: prop-2-ynyl 4-(carbamoylamino)-4-oxobut-2-enoate.
Chemical Property Profile of Prop-2-ynyl (Z)-3-(carbamoylcarbamoyl)prop-2-enoate
Property Insights of Prop-2-ynyl (Z)-3-(carbamoylcarbamoyl)prop-2-enoate
The XLogP value of -0.5 indicates that Prop-2-ynyl (Z)-3-(carbamoylcarbamoyl)prop-2-enoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 98.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Prop-2-ynyl (Z)-3-(carbamoylcarbamoyl)prop-2-enoate. Following Lipinski's Rule of Five, Prop-2-ynyl (Z)-3-(carbamoylcarbamoyl)prop-2-enoate has 2 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 Prop-2-ynyl (Z)-3-(carbamoylcarbamoyl)prop-2-enoate?
The CAS number of Prop-2-ynyl (Z)-3-(carbamoylcarbamoyl)prop-2-enoate is 92303-86-1.
What is the molecular formula of Prop-2-ynyl (Z)-3-(carbamoylcarbamoyl)prop-2-enoate?
The molecular formula of Prop-2-ynyl (Z)-3-(carbamoylcarbamoyl)prop-2-enoate is C8H8N2O4.
What is the molecular weight of Prop-2-ynyl (Z)-3-(carbamoylcarbamoyl)prop-2-enoate?
The molecular weight of Prop-2-ynyl (Z)-3-(carbamoylcarbamoyl)prop-2-enoate is 196.05 g/mol.
Where can I buy Prop-2-ynyl (Z)-3-(carbamoylcarbamoyl)prop-2-enoate?
You can request a quote for Prop-2-ynyl (Z)-3-(carbamoylcarbamoyl)prop-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Prop-2-ynyl (Z)-3-(carbamoylcarbamoyl)prop-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for Prop-2-ynyl (Z)-3-(carbamoylcarbamoyl)prop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.