Alloclamide
TL;DR: Alloclamide (CAS 5486-77-1) is a chemical compound with molecular formula C16H23ClN2O2 and molecular weight 310.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-[2-(diethylamino)ethyl]-2-prop-2-enoxybenzamide
Also Known As: Alloclamide, Aloclamida, Alloclamidum, Alloclamida, tuselin
| Molecular Formula | C16H23ClN2O2 |
|---|---|
| Molecular Weight | 310.14 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 41.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 310.1448 |
| Heavy Atoms | 21 |
| Complexity | 321.0 |
Chemical Identifiers
| CAS Number | 5486-77-1 |
|---|---|
| SMILES | CCN(CC)CCNC(=O)C1=C(C=C(C=C1)Cl)OCC=C |
| InChIKey | UHWFVIPXDFZTFA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Alloclamide (CAS 5486-77-1), with molecular formula C16H23ClN2O2 and molecular weight 310.14 g/mol. IUPAC: 4-chloro-N-[2-(diethylamino)ethyl]-2-prop-2-enoxybenzamide.
Chemical Property Profile of Alloclamide
Property Insights of Alloclamide
The XLogP value of 3.8 indicates that Alloclamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.6 Ų, Alloclamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Alloclamide has 1 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 Alloclamide?
The CAS number of Alloclamide is 5486-77-1.
What is the molecular formula of Alloclamide?
The molecular formula of Alloclamide is C16H23ClN2O2.
What is the molecular weight of Alloclamide?
The molecular weight of Alloclamide is 310.14 g/mol.
Where can I buy Alloclamide?
You can request a quote for Alloclamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Alloclamide?
Yes, KEHONG BIO provides custom synthesis services for Alloclamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.