Desethylmetoclopramide
TL;DR: Desethylmetoclopramide (CAS 27260-19-1) is a chemical compound with molecular formula C12H18ClN3O2 and molecular weight 271.10876 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-amino-5-chloro-N-[2-(ethylamino)ethyl]-2-methoxybenzamide
Also Known As: N-Desethyl Metoclopramide, Desethylmetoclopramide, Deetilmetoclopramide, Deetilato metoclopramide, Monoethyl metoclopramide
Technical Specifications
| Molecular Formula | C12H18ClN3O2 |
| Molecular Weight | 271.10876 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 76.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 271.10876 Da |
| Heavy Atoms | 18 |
| Complexity | 266.0 |
| SMILES | CCNCCNC(=O)C1=CC(=C(C=C1OC)N)Cl |
| InChIKey | RTQMQUZXBADBGJ-UHFFFAOYSA-N |
Chemical Property Profile of Desethylmetoclopramide
Property Insights of Desethylmetoclopramide
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Desethylmetoclopramide. The TPSA of 76.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Desethylmetoclopramide. Following Lipinski's Rule of Five, Desethylmetoclopramide has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Desethylmetoclopramide?
The CAS number of Desethylmetoclopramide is 27260-19-1.
What is the molecular formula of Desethylmetoclopramide?
The molecular formula of Desethylmetoclopramide is C12H18ClN3O2.
What is the molecular weight of Desethylmetoclopramide?
The molecular weight of Desethylmetoclopramide is 271.10876 g/mol.
Where can I buy Desethylmetoclopramide?
You can request a quote for Desethylmetoclopramide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Desethylmetoclopramide?
Yes, CoreyChem provides custom synthesis services for Desethylmetoclopramide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.