(4-bromophenyl)-(5-bromothiophen-2-yl)sulfonylazanide

C10H6Br2NO2S2- — CID 4748165

IUPAC(4-bromophenyl)-(5-bromothiophen-2-yl)sulfonylazanide
SMILESO=S(=O)([N-]c1ccc(Br)cc1)c1ccc(Br)s1
InChIInChI=1S/C10H6Br2NO2S2/c11-7-1-3-8(4-2-7)13-17(14,15)10-6-5-9(12)16-10/h1-6H/q-1
InChIKeyKIUYBPHRPPOQCK-UHFFFAOYSA-N
MW396.11 g/mol
LogP4.67
Rot. Bonds3

About (4-bromophenyl)-(5-bromothiophen-2-yl)sulfonylazanide

(4-bromophenyl)-(5-bromothiophen-2-yl)sulfonylazanide (PubChem CID 4748165) has the molecular formula C10H6Br2NO2S2- and a molecular weight of 396.11 g/mol. Its IUPAC name is (4-bromophenyl)-(5-bromothiophen-2-yl)sulfonylazanide.

Molecular Properties

Compound Name(4-bromophenyl)-(5-bromothiophen-2-yl)sulfonylazanide
PubChem CID4748165
Molecular FormulaC10H6Br2NO2S2-
Molecular Weight396.11 g/mol
Exact Mass393.82
IUPAC Name(4-bromophenyl)-(5-bromothiophen-2-yl)sulfonylazanide
SMILESO=S(=O)([N-]c1ccc(Br)cc1)c1ccc(Br)s1
InChIInChI=1S/C10H6Br2NO2S2/c11-7-1-3-8(4-2-7)13-17(14,15)10-6-5-9(12)16-10/h1-6H/q-1
InChIKeyKIUYBPHRPPOQCK-UHFFFAOYSA-N
XLogP4.67
TPSA48.24 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.11
LogP ≤ 54.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4-bromophenyl)-(5-bromothiophen-2-yl)sulfonylazanide?
The IUPAC name of (4-bromophenyl)-(5-bromothiophen-2-yl)sulfonylazanide (CID 4748165) is (4-bromophenyl)-(5-bromothiophen-2-yl)sulfonylazanide.
What is the SMILES notation for (4-bromophenyl)-(5-bromothiophen-2-yl)sulfonylazanide?
The canonical SMILES for (4-bromophenyl)-(5-bromothiophen-2-yl)sulfonylazanide is O=S(=O)([N-]c1ccc(Br)cc1)c1ccc(Br)s1.
What is the InChIKey of (4-bromophenyl)-(5-bromothiophen-2-yl)sulfonylazanide?
The InChIKey is KIUYBPHRPPOQCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Br2NO2S2/c11-7-1-3-8(4-2-7)13-17(14,15)10-6-5-9(12)16-10/h1-6H/q-1.
What are the key properties of (4-bromophenyl)-(5-bromothiophen-2-yl)sulfonylazanide?
(4-bromophenyl)-(5-bromothiophen-2-yl)sulfonylazanide has a molecular weight of 396.11 g/mol, XLogP of 4.67, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-bromophenyl)-(5-bromothiophen-2-yl)sulfonylazanide is sourced from PubChem (CID 4748165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).