N-[(1E)-2-(3-methoxyphenyl)-1-azavinyl](adamantanylamino)carboxamide
TL;DR: N-[(1E)-2-(3-methoxyphenyl)-1-azavinyl](adamantanylamino)carboxamide (CAS 348588-53-4) is a chemical compound with molecular formula C19H25N3O2 and molecular weight 327.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-adamantyl)-3-[(E)-(3-methoxyphenyl)methylideneamino]urea
Also Known As: N-[(1E)-2-(3-methoxyphenyl)-1-azavinyl](adamantanylamino)carboxamide, (2E)-2-(3-methoxybenzylidene)-N-(tricyclo[3.3.1.1~3,7~]dec-1-yl)hydrazinecarboxamide, (E)-N-((3s,5s,7s)-adamantan-1-yl)-2-(3-methoxybenzylidene)hydrazinecarboxamide
| Molecular Formula | C19H25N3O2 |
|---|---|
| Molecular Weight | 327.19 g/mol |
| LogP | 3.2971 |
| Topological Polar Surface Area | 62.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 327.19467 |
| Heavy Atoms | 24 |
| Complexity | 620.4827 |
Chemical Identifiers
| CAS Number | 348588-53-4 |
|---|---|
| SMILES | COC1=CC=CC(=C1)/C=N/NC(=O)NC23CC4CC(C2)CC(C4)C3 |
Product Overview
N-[(1E)-2-(3-methoxyphenyl)-1-azavinyl](adamantanylamino)carboxamide (CAS 348588-53-4), with molecular formula C19H25N3O2 and molecular weight 327.19 g/mol. IUPAC: 1-(1-adamantyl)-3-[(E)-(3-methoxyphenyl)methylideneamino]urea.
Chemical Property Profile of N-[(1E)-2-(3-methoxyphenyl)-1-azavinyl](adamantanylamino)carboxamide
Property Insights of N-[(1E)-2-(3-methoxyphenyl)-1-azavinyl](adamantanylamino)carboxamide
The XLogP value of 3.2971 indicates that N-[(1E)-2-(3-methoxyphenyl)-1-azavinyl](adamantanylamino)carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.72 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(1E)-2-(3-methoxyphenyl)-1-azavinyl](adamantanylamino)carboxamide. Following Lipinski's Rule of Five, N-[(1E)-2-(3-methoxyphenyl)-1-azavinyl](adamantanylamino)carboxamide has 2 hydrogen bond donor(s) and 3 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 N-[(1E)-2-(3-methoxyphenyl)-1-azavinyl](adamantanylamino)carboxamide?
The CAS number of N-[(1E)-2-(3-methoxyphenyl)-1-azavinyl](adamantanylamino)carboxamide is 348588-53-4.
What is the molecular formula of N-[(1E)-2-(3-methoxyphenyl)-1-azavinyl](adamantanylamino)carboxamide?
The molecular formula of N-[(1E)-2-(3-methoxyphenyl)-1-azavinyl](adamantanylamino)carboxamide is C19H25N3O2.
What is the molecular weight of N-[(1E)-2-(3-methoxyphenyl)-1-azavinyl](adamantanylamino)carboxamide?
The molecular weight of N-[(1E)-2-(3-methoxyphenyl)-1-azavinyl](adamantanylamino)carboxamide is 327.19 g/mol.
Where can I buy N-[(1E)-2-(3-methoxyphenyl)-1-azavinyl](adamantanylamino)carboxamide?
You can request a quote for N-[(1E)-2-(3-methoxyphenyl)-1-azavinyl](adamantanylamino)carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(1E)-2-(3-methoxyphenyl)-1-azavinyl](adamantanylamino)carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(1E)-2-(3-methoxyphenyl)-1-azavinyl](adamantanylamino)carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.