My ChemCD

538337-92-7
2-((4-BENZYL-5-(PHENOXYMETHYL)-4H-1,2,4-TRIAZOL-3-YL)THIO)-1-(4-F-PH)ETHANONE

Directory: 1. Identification; 2. Chemical and Physical Properties; 3. Material Safety Data Sheet(MSDS); 4. CML File; 5. TOP Suppliers; 6. Related products

Name

2-((4-BENZYL-5-(PHENOXYMETHYL)-4H-1,2,4-TRIAZOL-3-YL)THIO)-1-(4-F-PH)ETHANONE

Formula

C24 H20 F N3 O2 S

MolWeight

433.505

CCD No.

CCD00466947

CAS

538337-92-7

MDL

MFCD04426620

1Identification

【Name】

2-((4-BENZYL-5-(PHENOXYMETHYL)-4H-1,2,4-TRIAZOL-3-YL)THIO)-1-(4-F-PH)ETHANONE

【CAS】

538337-92-7

【MDL】

MFCD04426620

【English Synonyms】

2-((4-BENZYL-5-(PHENOXYMETHYL)-4H-1,2,4-TRIAZOL-3-YL)THIO)-1-(4-F-PH)ETHANONE

【Formula】

C24 H20 F N3 O2 S

【MolWeight】

433.505

【Inchi】

InChI=1S/C24H20FN3O2S/c25-20-13-11-19(12-14-20)22(29)17-31-24-27-26-23(16-30-21-9-5-2-6-10-21)28(24)15-18-7-3-1-4-8-18/h1-14H,15-17H2

【InChIKey】

InChIKey=BBWQRAWQEPNPTC-UHFFFAOYSA-N

【SMILES】

c1ccc(cc1)Cn2c(nnc2SCC(=O)c3ccc(cc3)F)COc4ccccc4

【MOL File】

2-((4-BENZYL-5-(PHEN….mol

2Chemical and Physical Properties

【Computed Properties】

H bond donor:0

H bond acceptor:5

XLogP3:5.0

Bulk/Fine:F

3Material Safety Data Sheet(MSDS)

4CML File

2-((4-BENZYL-5-(PHENOXYMETHYL)-4H-1,2,4-TRIAZOL-3-YL)THIO)-1-(4-F-PH)ETHANONE.cml

Quick Release

TOP Suppliers

Sigma-Aldrich Corporation
Catalog No:L443301-1EA 10MG
Country/Region:United States
Business Type:Reagent Company
http://www.sigma-aldrich.com

More 538337-92-7 Suppliers>>

538337-92-7 2-((4-BENZYL-5-(PHENOXYMETHYL)-4H-1,2,4-TRIAZOL-3-YL)THIO)-1-(4-F-PH)ETHANONE

1Identification

【Name】

【CAS】

【MDL】

【English Synonyms】

【Formula】

【MolWeight】

【Inchi】

【InChIKey】

【SMILES】

【MOL File】

2Chemical and Physical Properties

【Computed Properties】

3Material Safety Data Sheet(MSDS)

4CML File

TOP Suppliers

Related products

538337-92-7
2-((4-BENZYL-5-(PHENOXYMETHYL)-4H-1,2,4-TRIAZOL-3-YL)THIO)-1-(4-F-PH)ETHANONE