5-(2,5-difluorophenyl)-2-phenyl-2,3-dihydro-1,3,4-thiadiazole

C14H10F2N2S — CID 174715232

IUPAC5-(2,5-difluorophenyl)-2-phenyl-2,3-dihydro-1,3,4-thiadiazole
SMILESFc1ccc(F)c(C2=NNC(c3ccccc3)S2)c1
InChIInChI=1S/C14H10F2N2S/c15-10-6-7-12(16)11(8-10)14-18-17-13(19-14)9-4-2-1-3-5-9/h1-8,13,17H
InChIKeyGFYYWCNYPBDXAG-UHFFFAOYSA-N
MW276.31 g/mol
LogP3.66
Rot. Bonds2

About 5-(2,5-difluorophenyl)-2-phenyl-2,3-dihydro-1,3,4-thiadiazole

5-(2,5-difluorophenyl)-2-phenyl-2,3-dihydro-1,3,4-thiadiazole (PubChem CID 174715232) has the molecular formula C14H10F2N2S and a molecular weight of 276.31 g/mol. Its IUPAC name is 5-(2,5-difluorophenyl)-2-phenyl-2,3-dihydro-1,3,4-thiadiazole.

Molecular Properties

Compound Name5-(2,5-difluorophenyl)-2-phenyl-2,3-dihydro-1,3,4-thiadiazole
PubChem CID174715232
Molecular FormulaC14H10F2N2S
Molecular Weight276.31 g/mol
Exact Mass276.05
IUPAC Name5-(2,5-difluorophenyl)-2-phenyl-2,3-dihydro-1,3,4-thiadiazole
SMILESFc1ccc(F)c(C2=NNC(c3ccccc3)S2)c1
InChIInChI=1S/C14H10F2N2S/c15-10-6-7-12(16)11(8-10)14-18-17-13(19-14)9-4-2-1-3-5-9/h1-8,13,17H
InChIKeyGFYYWCNYPBDXAG-UHFFFAOYSA-N
XLogP3.66
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.31
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-Fluorophenyl)-5-(4-methylphenyl)-2,3-dihydro-1,3,4-thiadiazole
CID 3704631
2-(3-Fluorophenyl)-5-phenyl-2,3-dihydro-1,3,4-thiadiazole
CID 4395503
Methyl4-(5-phenyl-2,3-dihydro-1,3,4-thiadiazol-2-yl)phenylsulfide
CID 4570467
2-(4-Chlorophenyl)-5-phenyl-2,3-dihydro-1,3,4-thiadiazole
CID 2861132
N-benzyl-5-(3,4-difluorophenyl)-3,6-dihydro-1,3,4-thiadiazin-2-imine
CID 135512250
Mrnsnacrabgadq-uhfffaoysa-
CID 4585660
2-(4-Fluorophenyl)-5-(4-methylphenyl)-2,3-dihydro-1,3,4-thiadiazole
CID 2871209
(r,s)-5-Phenyl-2-p-tolyl-2,3-dihydro-[1,3,4]thiadiazole
CID 12885169
5-Phenyl-2-[4-(trifluoromethyl)phenyl]-2,3-dihydro-1,3,4-thiadiazole
CID 2871289
N-[(E)-(4-fluorophenyl)methylideneamino]-1-phenylmethanamine
CID 59855251
N-[(4-fluorophenyl)methylideneamino]-1-phenylmethanamine
CID 66619847
5-(2,5-Difluorophenyl)-2-methyl-2-phenyl-2,3-dihydro-1,3,4-thiadiazole
CID 68503997

Frequently Asked Questions

What is the IUPAC name of 5-(2,5-difluorophenyl)-2-phenyl-2,3-dihydro-1,3,4-thiadiazole?
The IUPAC name of 5-(2,5-difluorophenyl)-2-phenyl-2,3-dihydro-1,3,4-thiadiazole (CID 174715232) is 5-(2,5-difluorophenyl)-2-phenyl-2,3-dihydro-1,3,4-thiadiazole.
What is the SMILES notation for 5-(2,5-difluorophenyl)-2-phenyl-2,3-dihydro-1,3,4-thiadiazole?
The canonical SMILES for 5-(2,5-difluorophenyl)-2-phenyl-2,3-dihydro-1,3,4-thiadiazole is Fc1ccc(F)c(C2=NNC(c3ccccc3)S2)c1.
What is the InChIKey of 5-(2,5-difluorophenyl)-2-phenyl-2,3-dihydro-1,3,4-thiadiazole?
The InChIKey is GFYYWCNYPBDXAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10F2N2S/c15-10-6-7-12(16)11(8-10)14-18-17-13(19-14)9-4-2-1-3-5-9/h1-8,13,17H.
What are the key properties of 5-(2,5-difluorophenyl)-2-phenyl-2,3-dihydro-1,3,4-thiadiazole?
5-(2,5-difluorophenyl)-2-phenyl-2,3-dihydro-1,3,4-thiadiazole has a molecular weight of 276.31 g/mol, XLogP of 3.66, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,5-difluorophenyl)-2-phenyl-2,3-dihydro-1,3,4-thiadiazole is sourced from PubChem (CID 174715232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).