1-(Adamantan-1-yl)-3-(prop-2-enoyl)urea
TL;DR: 1-(Adamantan-1-yl)-3-(prop-2-enoyl)urea (CAS 852399-58-7) is a chemical compound with molecular formula C14H20N2O2 and molecular weight 248.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-adamantylcarbamoyl)prop-2-enamide
Also Known As: 1-(adamantan-1-yl)-3-(prop-2-enoyl)urea, N-(Adamantan-1-ylcarbamoyl)acrylamide, N-(1-adamantylcarbamoyl)prop-2-enamide, N-[(1-adamantylamino)carbonyl]acrylamide
| Molecular Formula | C14H20N2O2 |
|---|---|
| Molecular Weight | 248.15 g/mol |
| LogP | 1.967 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.15248 |
| Heavy Atoms | 18 |
| Complexity | 367.31396 |
Chemical Identifiers
| CAS Number | 852399-58-7 |
|---|---|
| SMILES | C=CC(=O)NC(=O)NC12CC3CC(C1)CC(C3)C2 |
Product Overview
1-(Adamantan-1-yl)-3-(prop-2-enoyl)urea (CAS 852399-58-7), with molecular formula C14H20N2O2 and molecular weight 248.15 g/mol. IUPAC: N-(1-adamantylcarbamoyl)prop-2-enamide.
Chemical Property Profile of 1-(Adamantan-1-yl)-3-(prop-2-enoyl)urea
Property Insights of 1-(Adamantan-1-yl)-3-(prop-2-enoyl)urea
The XLogP value of 1.967 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Adamantan-1-yl)-3-(prop-2-enoyl)urea. With a topological polar surface area (TPSA) of 58.2 Ų, 1-(Adamantan-1-yl)-3-(prop-2-enoyl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Adamantan-1-yl)-3-(prop-2-enoyl)urea has 2 hydrogen bond donor(s) and 2 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 1-(Adamantan-1-yl)-3-(prop-2-enoyl)urea?
The CAS number of 1-(Adamantan-1-yl)-3-(prop-2-enoyl)urea is 852399-58-7.
What is the molecular formula of 1-(Adamantan-1-yl)-3-(prop-2-enoyl)urea?
The molecular formula of 1-(Adamantan-1-yl)-3-(prop-2-enoyl)urea is C14H20N2O2.
What is the molecular weight of 1-(Adamantan-1-yl)-3-(prop-2-enoyl)urea?
The molecular weight of 1-(Adamantan-1-yl)-3-(prop-2-enoyl)urea is 248.15 g/mol.
Where can I buy 1-(Adamantan-1-yl)-3-(prop-2-enoyl)urea?
You can request a quote for 1-(Adamantan-1-yl)-3-(prop-2-enoyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Adamantan-1-yl)-3-(prop-2-enoyl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(Adamantan-1-yl)-3-(prop-2-enoyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.