1-Butanone, 1-(2,4-dichlorophenyl)-2-hydroxy-2-(1H-1,2,4-triazol-1-ylmethyl)-
TL;DR: 1-Butanone, 1-(2,4-dichlorophenyl)-2-hydroxy-2-(1H-1,2,4-triazol-1-ylmethyl)- (CAS 107659-07-4) is a chemical compound with molecular formula C13H13Cl2N3O2 and molecular weight 313.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,4-dichlorophenyl)-2-hydroxy-2-(1,2,4-triazol-1-ylmethyl)butan-1-one
Also Known As: 1-Butanone, 1-(2,4-dichlorophenyl)-2-hydroxy-2-(1H-1,2,4-triazol-1-ylmethyl)-, 1-(2,4-dichlorophenyl)-2-hydroxy-2-(1,2,4-triazol-1-ylmethyl)butan-1-one, 1-(2,4-DICHLOROPHENYL)-2-HYDROXY-2-(1H-1,2,4-TRIAZOL-1-YLMETHYL)-1-BUTANONE, 1-(2,4-Dichlorophenyl)-2-hydroxy-2-[(1H-1,2,4-triazol-1-yl)methyl]butan-1-one, L-Alanine,L-tryptophyl-L-a-glutamyl-L-alanyl-L-alanyl-L-leucyl-L-alanyl-L-a-glutamyl-L-alanyl-L-leucyl-L-alanyl-L-a-glutamyl-L-alanyl-L-leucyl-L-alanyl-L-a-glutamyl-L-histidyl-L-leucyl-L-alanyl-L-a-glutamyl-L-alanyl-L-leucyl-L-alanyl-L-a-glutamyl-L-alanyl-L-leucyl-L-a-glutamyl-L-alanyl-L-leucyl-L-alanyl-
| Molecular Formula | C13H13Cl2N3O2 |
|---|---|
| Molecular Weight | 313.04 g/mol |
| LogP | 2.6089 |
| Topological Polar Surface Area | 68.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 313.03848 |
| Heavy Atoms | 20 |
| Complexity | 616.08374 |
Chemical Identifiers
| CAS Number | 107659-07-4 |
|---|---|
| SMILES | CCC(CN1C=NC=N1)(C(=O)C2=C(C=C(C=C2)Cl)Cl)O |
Product Overview
1-Butanone, 1-(2,4-dichlorophenyl)-2-hydroxy-2-(1H-1,2,4-triazol-1-ylmethyl)- (CAS 107659-07-4), with molecular formula C13H13Cl2N3O2 and molecular weight 313.04 g/mol. IUPAC: 1-(2,4-dichlorophenyl)-2-hydroxy-2-(1,2,4-triazol-1-ylmethyl)butan-1-one.
Chemical Property Profile of 1-Butanone, 1-(2,4-dichlorophenyl)-2-hydroxy-2-(1H-1,2,4-triazol-1-ylmethyl)-
Property Insights of 1-Butanone, 1-(2,4-dichlorophenyl)-2-hydroxy-2-(1H-1,2,4-triazol-1-ylmethyl)-
The XLogP value of 2.6089 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Butanone, 1-(2,4-dichlorophenyl)-2-hydroxy-2-(1H-1,2,4-triazol-1-ylmethyl)-. The TPSA of 68.01 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Butanone, 1-(2,4-dichlorophenyl)-2-hydroxy-2-(1H-1,2,4-triazol-1-ylmethyl)-. Following Lipinski's Rule of Five, 1-Butanone, 1-(2,4-dichlorophenyl)-2-hydroxy-2-(1H-1,2,4-triazol-1-ylmethyl)- has 1 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 1-Butanone, 1-(2,4-dichlorophenyl)-2-hydroxy-2-(1H-1,2,4-triazol-1-ylmethyl)-?
The CAS number of 1-Butanone, 1-(2,4-dichlorophenyl)-2-hydroxy-2-(1H-1,2,4-triazol-1-ylmethyl)- is 107659-07-4.
What is the molecular formula of 1-Butanone, 1-(2,4-dichlorophenyl)-2-hydroxy-2-(1H-1,2,4-triazol-1-ylmethyl)-?
The molecular formula of 1-Butanone, 1-(2,4-dichlorophenyl)-2-hydroxy-2-(1H-1,2,4-triazol-1-ylmethyl)- is C13H13Cl2N3O2.
What is the molecular weight of 1-Butanone, 1-(2,4-dichlorophenyl)-2-hydroxy-2-(1H-1,2,4-triazol-1-ylmethyl)-?
The molecular weight of 1-Butanone, 1-(2,4-dichlorophenyl)-2-hydroxy-2-(1H-1,2,4-triazol-1-ylmethyl)- is 313.04 g/mol.
Where can I buy 1-Butanone, 1-(2,4-dichlorophenyl)-2-hydroxy-2-(1H-1,2,4-triazol-1-ylmethyl)-?
You can request a quote for 1-Butanone, 1-(2,4-dichlorophenyl)-2-hydroxy-2-(1H-1,2,4-triazol-1-ylmethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Butanone, 1-(2,4-dichlorophenyl)-2-hydroxy-2-(1H-1,2,4-triazol-1-ylmethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Butanone, 1-(2,4-dichlorophenyl)-2-hydroxy-2-(1H-1,2,4-triazol-1-ylmethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.