4-(4-fluorophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]-1,3-thiazole

C19H17F2N3S — CID 1263935

IUPAC4-(4-fluorophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]-1,3-thiazole
SMILESFc1ccc(-c2csc(N3CCN(c4ccccc4F)CC3)n2)cc1
InChIInChI=1S/C19H17F2N3S/c20-15-7-5-14(6-8-15)17-13-25-19(22-17)24-11-9-23(10-12-24)18-4-2-1-3-16(18)21/h1-8,13H,9-12H2
InChIKeyHZGWHELEYMNASN-UHFFFAOYSA-N
MW357.43 g/mol
LogP4.41
Rot. Bonds3

About 4-(4-fluorophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]-1,3-thiazole

4-(4-fluorophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]-1,3-thiazole (PubChem CID 1263935) has the molecular formula C19H17F2N3S and a molecular weight of 357.43 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]-1,3-thiazole.

Molecular Properties

Compound Name4-(4-fluorophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]-1,3-thiazole
PubChem CID1263935
Molecular FormulaC19H17F2N3S
Molecular Weight357.43 g/mol
Exact Mass357.11
IUPAC Name4-(4-fluorophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]-1,3-thiazole
SMILESFc1ccc(-c2csc(N3CCN(c4ccccc4F)CC3)n2)cc1
InChIInChI=1S/C19H17F2N3S/c20-15-7-5-14(6-8-15)17-13-25-19(22-17)24-11-9-23(10-12-24)18-4-2-1-3-16(18)21/h1-8,13H,9-12H2
InChIKeyHZGWHELEYMNASN-UHFFFAOYSA-N
XLogP4.41
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.43
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-Phenyl-N-(2-phenylethyl)-2-thiazolamine
CID 54339
2-(4-Benzylpiperazin-1-yl)-1,3-benzothiazole
CID 1484933
4-[4-(4-Fluorophenyl)-1,3-thiazol-2-yl]morpholine
CID 683402
N-aryl-4-aryl-1,3-thiazole-2-amine, 25
CID 972657
N-aryl-4-aryl-1,3-thiazole-2-amine, 32
CID 25101200
2-(p-Aminoanilino)-4-phenyl-thiazole
CID 697284
1-(Methylsulfonyl)-4-(4-phenyl-1,3-thiazol-2-yl)piperazine
CID 618556
2-(4-Phenyl-1,3-thiazol-2-yl)-1,2,3,4-tetrahydroisoquinoline
CID 686187
1-(4-Phenyl-1,3-thiazol-2-yl)piperidine
CID 879105
4-(4-Fluorophenyl)-N-phenyl-1,3-thiazol-2-amine
CID 1284592
4-(4-Phenyl-thiazol-2-yl)-piperazine-1-carboxylic acid dimethylamide
CID 778223
1-[4-(4-Fluorophenyl)-1,3-thiazol-2-yl]-3-phenylthiourea
CID 930568

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]-1,3-thiazole?
The IUPAC name of 4-(4-fluorophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]-1,3-thiazole (CID 1263935) is 4-(4-fluorophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]-1,3-thiazole.
What is the SMILES notation for 4-(4-fluorophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]-1,3-thiazole?
The canonical SMILES for 4-(4-fluorophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]-1,3-thiazole is Fc1ccc(-c2csc(N3CCN(c4ccccc4F)CC3)n2)cc1.
What is the InChIKey of 4-(4-fluorophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]-1,3-thiazole?
The InChIKey is HZGWHELEYMNASN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17F2N3S/c20-15-7-5-14(6-8-15)17-13-25-19(22-17)24-11-9-23(10-12-24)18-4-2-1-3-16(18)21/h1-8,13H,9-12H2.
What are the key properties of 4-(4-fluorophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]-1,3-thiazole?
4-(4-fluorophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]-1,3-thiazole has a molecular weight of 357.43 g/mol, XLogP of 4.41, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]-1,3-thiazole is sourced from PubChem (CID 1263935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).