Prop-2-enyl 4-(carbamoylamino)-4-oxobut-2-enoate
TL;DR: Prop-2-enyl 4-(carbamoylamino)-4-oxobut-2-enoate (CAS 6951-82-2) is a chemical compound with molecular formula C8H10N2O4 and molecular weight 198.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
prop-2-enyl 4-(carbamoylamino)-4-oxobut-2-enoate
Also Known As: prop-2-enyl 4-(carbamoylamino)-4-oxobut-2-enoate, 4-keto-4-ureido-but-2-enoic acid allyl ester, prop-2-en-1-yl 4-(carbamoylamino)-4-oxobut-2-enoate, 4-(carbamoylamino)-4-oxo-2-butenoic acid prop-2-enyl ester, PROP-2-ENYL (Z)-3-(CARBAMOYLCARBAMOYL)PROP-2-ENOATE
| Molecular Formula | C8H10N2O4 |
|---|---|
| Molecular Weight | 198.06 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 98.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 198.06406 |
| Heavy Atoms | 14 |
| Complexity | 283.0 |
Chemical Identifiers
| CAS Number | 6951-82-2 |
|---|---|
| SMILES | C=CCOC(=O)C=CC(=O)NC(=O)N |
| InChIKey | CIQGPYSOLICHIH-UHFFFAOYSA-N |
Product Overview
Prop-2-enyl 4-(carbamoylamino)-4-oxobut-2-enoate (CAS 6951-82-2), with molecular formula C8H10N2O4 and molecular weight 198.06 g/mol. IUPAC: prop-2-enyl 4-(carbamoylamino)-4-oxobut-2-enoate.
Chemical Property Profile of Prop-2-enyl 4-(carbamoylamino)-4-oxobut-2-enoate
Property Insights of Prop-2-enyl 4-(carbamoylamino)-4-oxobut-2-enoate
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Prop-2-enyl 4-(carbamoylamino)-4-oxobut-2-enoate. The TPSA of 98.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Prop-2-enyl 4-(carbamoylamino)-4-oxobut-2-enoate. Following Lipinski's Rule of Five, Prop-2-enyl 4-(carbamoylamino)-4-oxobut-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-enyl 4-(carbamoylamino)-4-oxobut-2-enoate?
The CAS number of Prop-2-enyl 4-(carbamoylamino)-4-oxobut-2-enoate is 6951-82-2.
What is the molecular formula of Prop-2-enyl 4-(carbamoylamino)-4-oxobut-2-enoate?
The molecular formula of Prop-2-enyl 4-(carbamoylamino)-4-oxobut-2-enoate is C8H10N2O4.
What is the molecular weight of Prop-2-enyl 4-(carbamoylamino)-4-oxobut-2-enoate?
The molecular weight of Prop-2-enyl 4-(carbamoylamino)-4-oxobut-2-enoate is 198.06 g/mol.
Where can I buy Prop-2-enyl 4-(carbamoylamino)-4-oxobut-2-enoate?
You can request a quote for Prop-2-enyl 4-(carbamoylamino)-4-oxobut-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-enyl 4-(carbamoylamino)-4-oxobut-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for Prop-2-enyl 4-(carbamoylamino)-4-oxobut-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.