1-(sulfinylamino)-2-[2-(sulfinylamino)phenoxy]benzene

C12H8N2O3S2 — CID 6424592

IUPAC1-(sulfinylamino)-2-[2-(sulfinylamino)phenoxy]benzene
SMILESO=S=Nc1ccccc1Oc1ccccc1N=S=O
InChIInChI=1S/C12H8N2O3S2/c15-18-13-9-5-1-3-7-11(9)17-12-8-4-2-6-10(12)14-19-16/h1-8H
InChIKeyNZQVHEPFDKWJQL-UHFFFAOYSA-N
MW292.34 g/mol
LogP3.54
Rot. Bonds4

About 1-(sulfinylamino)-2-[2-(sulfinylamino)phenoxy]benzene

1-(sulfinylamino)-2-[2-(sulfinylamino)phenoxy]benzene (PubChem CID 6424592) has the molecular formula C12H8N2O3S2 and a molecular weight of 292.34 g/mol. Its IUPAC name is 1-(sulfinylamino)-2-[2-(sulfinylamino)phenoxy]benzene.

Molecular Properties

Compound Name1-(sulfinylamino)-2-[2-(sulfinylamino)phenoxy]benzene
PubChem CID6424592
Molecular FormulaC12H8N2O3S2
Molecular Weight292.34 g/mol
Exact Mass292.00
IUPAC Name1-(sulfinylamino)-2-[2-(sulfinylamino)phenoxy]benzene
SMILESO=S=Nc1ccccc1Oc1ccccc1N=S=O
InChIInChI=1S/C12H8N2O3S2/c15-18-13-9-5-1-3-7-11(9)17-12-8-4-2-6-10(12)14-19-16/h1-8H
InChIKeyNZQVHEPFDKWJQL-UHFFFAOYSA-N
XLogP3.54
TPSA68.09 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(sulfinylamino)-2-[2-(sulfinylamino)phenoxy]benzene?
The IUPAC name of 1-(sulfinylamino)-2-[2-(sulfinylamino)phenoxy]benzene (CID 6424592) is 1-(sulfinylamino)-2-[2-(sulfinylamino)phenoxy]benzene.
What is the SMILES notation for 1-(sulfinylamino)-2-[2-(sulfinylamino)phenoxy]benzene?
The canonical SMILES for 1-(sulfinylamino)-2-[2-(sulfinylamino)phenoxy]benzene is O=S=Nc1ccccc1Oc1ccccc1N=S=O.
What is the InChIKey of 1-(sulfinylamino)-2-[2-(sulfinylamino)phenoxy]benzene?
The InChIKey is NZQVHEPFDKWJQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8N2O3S2/c15-18-13-9-5-1-3-7-11(9)17-12-8-4-2-6-10(12)14-19-16/h1-8H.
What are the key properties of 1-(sulfinylamino)-2-[2-(sulfinylamino)phenoxy]benzene?
1-(sulfinylamino)-2-[2-(sulfinylamino)phenoxy]benzene has a molecular weight of 292.34 g/mol, XLogP of 3.54, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(sulfinylamino)-2-[2-(sulfinylamino)phenoxy]benzene is sourced from PubChem (CID 6424592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).