5-bromo-N-(2-bromo-4-fluorophenyl)thiophene-2-carboxamide

C11H6Br2FNOS — CID 28938680

IUPAC5-bromo-N-(2-bromo-4-fluorophenyl)thiophene-2-carboxamide
SMILESO=C(Nc1ccc(F)cc1Br)c1ccc(Br)s1
InChIInChI=1S/C11H6Br2FNOS/c12-7-5-6(14)1-2-8(7)15-11(16)9-3-4-10(13)17-9/h1-5H,(H,15,16)
InChIKeyIBWHHPHVIVPVRQ-UHFFFAOYSA-N
MW379.05 g/mol
LogP4.66
Rot. Bonds2

About 5-bromo-N-(2-bromo-4-fluorophenyl)thiophene-2-carboxamide

5-bromo-N-(2-bromo-4-fluorophenyl)thiophene-2-carboxamide (PubChem CID 28938680) has the molecular formula C11H6Br2FNOS and a molecular weight of 379.05 g/mol. Its IUPAC name is 5-bromo-N-(2-bromo-4-fluorophenyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(2-bromo-4-fluorophenyl)thiophene-2-carboxamide
PubChem CID28938680
Molecular FormulaC11H6Br2FNOS
Molecular Weight379.05 g/mol
Exact Mass376.85
IUPAC Name5-bromo-N-(2-bromo-4-fluorophenyl)thiophene-2-carboxamide
SMILESO=C(Nc1ccc(F)cc1Br)c1ccc(Br)s1
InChIInChI=1S/C11H6Br2FNOS/c12-7-5-6(14)1-2-8(7)15-11(16)9-3-4-10(13)17-9/h1-5H,(H,15,16)
InChIKeyIBWHHPHVIVPVRQ-UHFFFAOYSA-N
XLogP4.66
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.05
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-amino-2-bromophenyl)-5-bromothiophene-2-carboxamide
CID 43549542
5-bromo-N-(2-carbamothioyl-4-fluorophenyl)thiophene-2-carboxamide
CID 82015439
N-(2-bromo-4-fluorophenyl)thiophene-2-carboxamide
CID 28938543
5-bromo-N-(5-bromo-2-fluorophenyl)thiophene-2-carboxamide
CID 61076675
N-(2-bromo-4-fluorophenyl)-4-fluorobenzamide
CID 28938573
N-(2-bromo-4-fluorophenyl)-5-chloro-1,3,4-thiadiazole-2-carboxamide
CID 80625157
(2-bromo-4-fluorophenyl)urea
CID 28939155
4-bromo-N-(2-bromo-4-fluorophenyl)-3-fluorobenzamide
CID 47421840
N-(2-bromo-4-fluorophenyl)-4-fluoro-2-methylbenzamide
CID 112702520
N-(2-bromo-4-fluorophenyl)-3,5-dichlorobenzamide
CID 28938547
N-(2-bromo-4-fluorophenyl)pyridine-4-carboxamide
CID 28938574
2-[(5-bromothiophene-2-carbonyl)amino]-5-iodobenzoic acid
CID 45345767

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(2-bromo-4-fluorophenyl)thiophene-2-carboxamide?
The IUPAC name of 5-bromo-N-(2-bromo-4-fluorophenyl)thiophene-2-carboxamide (CID 28938680) is 5-bromo-N-(2-bromo-4-fluorophenyl)thiophene-2-carboxamide.
What is the SMILES notation for 5-bromo-N-(2-bromo-4-fluorophenyl)thiophene-2-carboxamide?
The canonical SMILES for 5-bromo-N-(2-bromo-4-fluorophenyl)thiophene-2-carboxamide is O=C(Nc1ccc(F)cc1Br)c1ccc(Br)s1.
What is the InChIKey of 5-bromo-N-(2-bromo-4-fluorophenyl)thiophene-2-carboxamide?
The InChIKey is IBWHHPHVIVPVRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6Br2FNOS/c12-7-5-6(14)1-2-8(7)15-11(16)9-3-4-10(13)17-9/h1-5H,(H,15,16).
What are the key properties of 5-bromo-N-(2-bromo-4-fluorophenyl)thiophene-2-carboxamide?
5-bromo-N-(2-bromo-4-fluorophenyl)thiophene-2-carboxamide has a molecular weight of 379.05 g/mol, XLogP of 4.66, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(2-bromo-4-fluorophenyl)thiophene-2-carboxamide is sourced from PubChem (CID 28938680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).