![4-[(3,5-dichloro-1H-1,2,4-triazol-1-yl)acetyl]morpholine structure](/static/products/7273/727386-68-7.webp)
4-[(3,5-dichloro-1H-1,2,4-triazol-1-yl)acetyl]morpholine
TL;DR: 4-[(3,5-dichloro-1H-1,2,4-triazol-1-yl)acetyl]morpholine (CAS 727386-68-7) is a chemical compound with molecular formula C8H10Cl2N4O2 and molecular weight 264.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,5-dichloro-1,2,4-triazol-1-yl)-1-morpholin-4-ylethanone
Also Known As: 4-[(3,5-dichloro-1H-1,2,4-triazol-1-yl)acetyl]morpholine, BAS 05496365, AP-853/41543855, 2-(3,5-dichloro-1,2,4-triazol-1-yl)-1-morpholin-4-ylethanone, 2-(3,5-Dichloro-[1,2,4]triazol-1-yl)-1-morpholin-4-yl-ethanone
| Molecular Formula | C8H10Cl2N4O2 |
|---|---|
| Molecular Weight | 264.02 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 60.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 264.01807 |
| Heavy Atoms | 16 |
| Complexity | 262.0 |
Chemical Identifiers
| CAS Number | 727386-68-7 |
|---|---|
| SMILES | C1COCCN1C(=O)CN2C(=NC(=N2)Cl)Cl |
| InChIKey | GTQMNSGFOUXPOV-UHFFFAOYSA-N |
Product Overview
4-[(3,5-dichloro-1H-1,2,4-triazol-1-yl)acetyl]morpholine (CAS 727386-68-7), with molecular formula C8H10Cl2N4O2 and molecular weight 264.02 g/mol. IUPAC: 2-(3,5-dichloro-1,2,4-triazol-1-yl)-1-morpholin-4-ylethanone.
Chemical Property Profile of 4-[(3,5-dichloro-1H-1,2,4-triazol-1-yl)acetyl]morpholine
Property Insights of 4-[(3,5-dichloro-1H-1,2,4-triazol-1-yl)acetyl]morpholine
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(3,5-dichloro-1H-1,2,4-triazol-1-yl)acetyl]morpholine. The TPSA of 60.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(3,5-dichloro-1H-1,2,4-triazol-1-yl)acetyl]morpholine. Following Lipinski's Rule of Five, 4-[(3,5-dichloro-1H-1,2,4-triazol-1-yl)acetyl]morpholine has 0 hydrogen bond donor(s) and 4 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 4-[(3,5-dichloro-1H-1,2,4-triazol-1-yl)acetyl]morpholine?
The CAS number of 4-[(3,5-dichloro-1H-1,2,4-triazol-1-yl)acetyl]morpholine is 727386-68-7.
What is the molecular formula of 4-[(3,5-dichloro-1H-1,2,4-triazol-1-yl)acetyl]morpholine?
The molecular formula of 4-[(3,5-dichloro-1H-1,2,4-triazol-1-yl)acetyl]morpholine is C8H10Cl2N4O2.
What is the molecular weight of 4-[(3,5-dichloro-1H-1,2,4-triazol-1-yl)acetyl]morpholine?
The molecular weight of 4-[(3,5-dichloro-1H-1,2,4-triazol-1-yl)acetyl]morpholine is 264.02 g/mol.
Where can I buy 4-[(3,5-dichloro-1H-1,2,4-triazol-1-yl)acetyl]morpholine?
You can request a quote for 4-[(3,5-dichloro-1H-1,2,4-triazol-1-yl)acetyl]morpholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(3,5-dichloro-1H-1,2,4-triazol-1-yl)acetyl]morpholine?
Yes, KEHONG BIO provides custom synthesis services for 4-[(3,5-dichloro-1H-1,2,4-triazol-1-yl)acetyl]morpholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.