(1S,3s,E)-N'-(2,4-difluorobenzylidene)adamantane-1-carbohydrazide
TL;DR: (1S,3s,E)-N'-(2,4-difluorobenzylidene)adamantane-1-carbohydrazide (CAS 363604-79-9) is a chemical compound with molecular formula C18H20F2N2O and molecular weight 318.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-(2,4-difluorophenyl)methylideneamino]adamantane-1-carboxamide
Also Known As: (1S,3s,E)-N'-(2,4-difluorobenzylidene)adamantane-1-carbohydrazide, N-[(E)-(2,4-difluorophenyl)methylideneamino]adamantane-1-carboxamide, F0346-0925, N'-[(1E)-(2,4-DIFLUOROPHENYL)METHYLIDENE]ADAMANTANE-1-CARBOHYDRAZIDE, N'-[(E)-(2,4-DIFLUOROPHENYL)METHYLIDENE]ADAMANTANE-1-CARBOHYDRAZIDE
| Molecular Formula | C18H20F2N2O |
|---|---|
| Molecular Weight | 318.15 g/mol |
| LogP | 3.6313 |
| Topological Polar Surface Area | 41.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 318.15436 |
| Heavy Atoms | 23 |
| Complexity | 635.70123 |
Chemical Identifiers
| CAS Number | 363604-79-9 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)C(=O)N/N=C/C4=C(C=C(C=C4)F)F |
Product Overview
(1S,3s,E)-N'-(2,4-difluorobenzylidene)adamantane-1-carbohydrazide (CAS 363604-79-9), with molecular formula C18H20F2N2O and molecular weight 318.15 g/mol. IUPAC: N-[(E)-(2,4-difluorophenyl)methylideneamino]adamantane-1-carboxamide.
Chemical Property Profile of (1S,3s,E)-N'-(2,4-difluorobenzylidene)adamantane-1-carbohydrazide
Property Insights of (1S,3s,E)-N'-(2,4-difluorobenzylidene)adamantane-1-carbohydrazide
The XLogP value of 3.6313 indicates that (1S,3s,E)-N'-(2,4-difluorobenzylidene)adamantane-1-carbohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.46 Ų, (1S,3s,E)-N'-(2,4-difluorobenzylidene)adamantane-1-carbohydrazide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1S,3s,E)-N'-(2,4-difluorobenzylidene)adamantane-1-carbohydrazide has 1 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 (1S,3s,E)-N'-(2,4-difluorobenzylidene)adamantane-1-carbohydrazide?
The CAS number of (1S,3s,E)-N'-(2,4-difluorobenzylidene)adamantane-1-carbohydrazide is 363604-79-9.
What is the molecular formula of (1S,3s,E)-N'-(2,4-difluorobenzylidene)adamantane-1-carbohydrazide?
The molecular formula of (1S,3s,E)-N'-(2,4-difluorobenzylidene)adamantane-1-carbohydrazide is C18H20F2N2O.
What is the molecular weight of (1S,3s,E)-N'-(2,4-difluorobenzylidene)adamantane-1-carbohydrazide?
The molecular weight of (1S,3s,E)-N'-(2,4-difluorobenzylidene)adamantane-1-carbohydrazide is 318.15 g/mol.
Where can I buy (1S,3s,E)-N'-(2,4-difluorobenzylidene)adamantane-1-carbohydrazide?
You can request a quote for (1S,3s,E)-N'-(2,4-difluorobenzylidene)adamantane-1-carbohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1S,3s,E)-N'-(2,4-difluorobenzylidene)adamantane-1-carbohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (1S,3s,E)-N'-(2,4-difluorobenzylidene)adamantane-1-carbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.