1-(1-adamantyl)-3-[(E)-(2-nitrophenyl)methylideneamino]urea
TL;DR: 1-(1-adamantyl)-3-[(E)-(2-nitrophenyl)methylideneamino]urea (CAS 324062-47-7) is a chemical compound with molecular formula C18H22N4O3 and molecular weight 342.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-adamantyl)-3-[(E)-(2-nitrophenyl)methylideneamino]urea
Also Known As: 1-(1-adamantyl)-3-[(E)-(2-nitrophenyl)methylideneamino]urea, (E)-N-((3s,5s,7s)-adamantan-1-yl)-2-(2-nitrobenzylidene)hydrazinecarboxamide, F0035-0414, 3-(adamantan-1-yl)-1-[(E)-[(2-nitrophenyl)methylidene]amino]urea
| Molecular Formula | C18H22N4O3 |
|---|---|
| Molecular Weight | 342.17 g/mol |
| LogP | 3.1967 |
| Topological Polar Surface Area | 96.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 342.1692 |
| Heavy Atoms | 25 |
| Complexity | 695.5021 |
Chemical Identifiers
| CAS Number | 324062-47-7 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)NC(=O)N/N=C/C4=CC=CC=C4[N+](=O)[O-] |
Product Overview
1-(1-adamantyl)-3-[(E)-(2-nitrophenyl)methylideneamino]urea (CAS 324062-47-7), with molecular formula C18H22N4O3 and molecular weight 342.17 g/mol. IUPAC: 1-(1-adamantyl)-3-[(E)-(2-nitrophenyl)methylideneamino]urea.
Chemical Property Profile of 1-(1-adamantyl)-3-[(E)-(2-nitrophenyl)methylideneamino]urea
Property Insights of 1-(1-adamantyl)-3-[(E)-(2-nitrophenyl)methylideneamino]urea
The XLogP value of 3.1967 indicates that 1-(1-adamantyl)-3-[(E)-(2-nitrophenyl)methylideneamino]urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(1-adamantyl)-3-[(E)-(2-nitrophenyl)methylideneamino]urea. Following Lipinski's Rule of Five, 1-(1-adamantyl)-3-[(E)-(2-nitrophenyl)methylideneamino]urea 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 1-(1-adamantyl)-3-[(E)-(2-nitrophenyl)methylideneamino]urea?
The CAS number of 1-(1-adamantyl)-3-[(E)-(2-nitrophenyl)methylideneamino]urea is 324062-47-7.
What is the molecular formula of 1-(1-adamantyl)-3-[(E)-(2-nitrophenyl)methylideneamino]urea?
The molecular formula of 1-(1-adamantyl)-3-[(E)-(2-nitrophenyl)methylideneamino]urea is C18H22N4O3.
What is the molecular weight of 1-(1-adamantyl)-3-[(E)-(2-nitrophenyl)methylideneamino]urea?
The molecular weight of 1-(1-adamantyl)-3-[(E)-(2-nitrophenyl)methylideneamino]urea is 342.17 g/mol.
Where can I buy 1-(1-adamantyl)-3-[(E)-(2-nitrophenyl)methylideneamino]urea?
You can request a quote for 1-(1-adamantyl)-3-[(E)-(2-nitrophenyl)methylideneamino]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1-adamantyl)-3-[(E)-(2-nitrophenyl)methylideneamino]urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(1-adamantyl)-3-[(E)-(2-nitrophenyl)methylideneamino]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.