N,4-bis(4-fluorophenyl)-1,3-thiazol-2-amine;hydrobromide

C15H11BrF2N2S — CID 2840600

IUPACN,4-bis(4-fluorophenyl)-1,3-thiazol-2-amine;hydrobromide
SMILESBr.Fc1ccc(Nc2nc(-c3ccc(F)cc3)cs2)cc1
InChIInChI=1S/C15H10F2N2S.BrH/c16-11-3-1-10(2-4-11)14-9-20-15(19-14)18-13-7-5-12(17)6-8-13;/h1-9H,(H,18,19);1H
InChIKeyFGPKAMREEWGCIU-UHFFFAOYSA-N
MW369.23 g/mol
LogP5.41
Rot. Bonds3

About N,4-bis(4-fluorophenyl)-1,3-thiazol-2-amine;hydrobromide

N,4-bis(4-fluorophenyl)-1,3-thiazol-2-amine;hydrobromide (PubChem CID 2840600) has the molecular formula C15H11BrF2N2S and a molecular weight of 369.23 g/mol. Its IUPAC name is N,4-bis(4-fluorophenyl)-1,3-thiazol-2-amine;hydrobromide.

Molecular Properties

Compound NameN,4-bis(4-fluorophenyl)-1,3-thiazol-2-amine;hydrobromide
PubChem CID2840600
Molecular FormulaC15H11BrF2N2S
Molecular Weight369.23 g/mol
Exact Mass367.98
IUPAC NameN,4-bis(4-fluorophenyl)-1,3-thiazol-2-amine;hydrobromide
SMILESBr.Fc1ccc(Nc2nc(-c3ccc(F)cc3)cs2)cc1
InChIInChI=1S/C15H10F2N2S.BrH/c16-11-3-1-10(2-4-11)14-9-20-15(19-14)18-13-7-5-12(17)6-8-13;/h1-9H,(H,18,19);1H
InChIKeyFGPKAMREEWGCIU-UHFFFAOYSA-N
XLogP5.41
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500369.23
LogP ≤ 55.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-fluorophenyl)-4-(4-methylphenyl)-1,3-thiazol-2-amine;hydrobromide
CID 2840281
N-(4-fluorophenyl)-4-pyridin-4-yl-1,3-thiazol-2-amine;hydrochloride
CID 163328871
4-(4-fluorophenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine
CID 4093037
4-(4-fluorophenyl)-N-(4-phenoxyphenyl)-1,3-thiazol-2-amine;hydrobromide
CID 2858168
4-(3,4-dichlorophenyl)-N-(4-fluorophenyl)-1,3-thiazol-2-amine
CID 166194872
N-(4-fluorophenyl)-4-(4-pyrrolidin-1-ylphenyl)-1,3-thiazol-2-amine
CID 134126795
N-[4-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]amino]phenyl]propanamide
CID 156772101
4-(4-fluorophenyl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine;hydrobromide
CID 44789502
N-(4-fluorophenyl)-4-pyridin-2-yl-1,3-thiazol-2-amine;hydrobromide
CID 91800824
4-(3-chloro-4-methoxyphenyl)-N-(4-fluorophenyl)-1,3-thiazol-2-amine
CID 166194851
4-(4-fluorophenyl)-N-(3-phenoxyphenyl)-1,3-thiazol-2-amine
CID 58791434
N-ethyl-4-(4-fluorophenyl)-1,3-thiazol-2-amine
CID 1132723

Frequently Asked Questions

What is the IUPAC name of N,4-bis(4-fluorophenyl)-1,3-thiazol-2-amine;hydrobromide?
The IUPAC name of N,4-bis(4-fluorophenyl)-1,3-thiazol-2-amine;hydrobromide (CID 2840600) is N,4-bis(4-fluorophenyl)-1,3-thiazol-2-amine;hydrobromide.
What is the SMILES notation for N,4-bis(4-fluorophenyl)-1,3-thiazol-2-amine;hydrobromide?
The canonical SMILES for N,4-bis(4-fluorophenyl)-1,3-thiazol-2-amine;hydrobromide is Br.Fc1ccc(Nc2nc(-c3ccc(F)cc3)cs2)cc1.
What is the InChIKey of N,4-bis(4-fluorophenyl)-1,3-thiazol-2-amine;hydrobromide?
The InChIKey is FGPKAMREEWGCIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10F2N2S.BrH/c16-11-3-1-10(2-4-11)14-9-20-15(19-14)18-13-7-5-12(17)6-8-13;/h1-9H,(H,18,19);1H.
What are the key properties of N,4-bis(4-fluorophenyl)-1,3-thiazol-2-amine;hydrobromide?
N,4-bis(4-fluorophenyl)-1,3-thiazol-2-amine;hydrobromide has a molecular weight of 369.23 g/mol, XLogP of 5.41, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-bis(4-fluorophenyl)-1,3-thiazol-2-amine;hydrobromide is sourced from PubChem (CID 2840600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).