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 CID | 4748165 |
| Molecular Formula | C10H6Br2NO2S2- |
| Molecular Weight | 396.11 g/mol |
| Exact Mass | 393.82 |
| IUPAC Name | (4-bromophenyl)-(5-bromothiophen-2-yl)sulfonylazanide |
| SMILES | O=S(=O)([N-]c1ccc(Br)cc1)c1ccc(Br)s1 |
| InChI | 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 |
| InChIKey | KIUYBPHRPPOQCK-UHFFFAOYSA-N |
| XLogP | 4.67 |
| TPSA | 48.24 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 396.11 |
| LogP ≤ 5 | 4.67 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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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).