![N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]-2-chlorobenzamide structure](/static/products/3324/332415-88-0.webp)
N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]-2-chlorobenzamide
TL;DR: N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]-2-chlorobenzamide (CAS 332415-88-0) is a chemical compound with molecular formula C21H26ClN3O2 and molecular weight 387.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]-2-chlorobenzamide
Also Known As: BAS 00474744, BIM-0028031.P001, N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]-2-chlorobenzamide, N-Adamantan-1-yl-3-[(2-chloro-benzoyl)-hydrazono]-butyramide, (3E)-N-adamantanyl-4-[(2-chlorophenyl)carbonylamino]-3-methyl-4-azabut-3-enami de
| Molecular Formula | C21H26ClN3O2 |
|---|---|
| Molecular Weight | 387.17 g/mol |
| LogP | 3.9208 |
| Topological Polar Surface Area | 70.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 387.17136 |
| Heavy Atoms | 27 |
| Complexity | 754.1021 |
Chemical Identifiers
| CAS Number | 332415-88-0 |
|---|---|
| SMILES | C/C(=N\NC(=O)C1=CC=CC=C1Cl)/CC(=O)NC23CC4CC(C2)CC(C4)C3 |
Product Overview
N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]-2-chlorobenzamide (CAS 332415-88-0), with molecular formula C21H26ClN3O2 and molecular weight 387.17 g/mol. IUPAC: N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]-2-chlorobenzamide.
Chemical Property Profile of N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]-2-chlorobenzamide
Property Insights of N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]-2-chlorobenzamide
The XLogP value of 3.9208 indicates that N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]-2-chlorobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.56 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]-2-chlorobenzamide. Following Lipinski's Rule of Five, N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]-2-chlorobenzamide 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-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]-2-chlorobenzamide?
The CAS number of N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]-2-chlorobenzamide is 332415-88-0.
What is the molecular formula of N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]-2-chlorobenzamide?
The molecular formula of N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]-2-chlorobenzamide is C21H26ClN3O2.
What is the molecular weight of N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]-2-chlorobenzamide?
The molecular weight of N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]-2-chlorobenzamide is 387.17 g/mol.
Where can I buy N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]-2-chlorobenzamide?
You can request a quote for N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]-2-chlorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]-2-chlorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]-2-chlorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.