CID 174966153

C2H6N4O4S — CID 174966153

IUPAC—
SMILESN=S(=O)=O.NC(=O)NC(N)=O
InChIInChI=1S/C2H5N3O2.HNO2S/c3-1(6)5-2(4)7;1-4(2)3/h(H5,3,4,5,6,7);1H
InChIKeyDYHLOWVUTDFTKX-UHFFFAOYSA-N
MW182.16 g/mol
LogP-1.64
Rot. Bonds

About CID 174966153

CID 174966153 (PubChem CID 174966153) has the molecular formula C2H6N4O4S and a molecular weight of 182.16 g/mol.

Molecular Properties

Compound NameCID 174966153
PubChem CID174966153
Molecular FormulaC2H6N4O4S
Molecular Weight182.16 g/mol
Exact Mass182.01
IUPAC Name—
SMILESN=S(=O)=O.NC(=O)NC(N)=O
InChIInChI=1S/C2H5N3O2.HNO2S/c3-1(6)5-2(4)7;1-4(2)3/h(H5,3,4,5,6,7);1H
InChIKeyDYHLOWVUTDFTKX-UHFFFAOYSA-N
XLogP-1.64
TPSA156.20 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.16
LogP ≤ 5-1.64
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

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CID 174833277
carbamoylurea;1,6-diisocyanatohexane
CID 160742694
lithium urea
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Frequently Asked Questions

What is the IUPAC name of CID 174966153?
The IUPAC name of CID 174966153 (CID 174966153) is not available.
What is the SMILES notation for CID 174966153?
The canonical SMILES for CID 174966153 is N=S(=O)=O.NC(=O)NC(N)=O.
What is the InChIKey of CID 174966153?
The InChIKey is DYHLOWVUTDFTKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5N3O2.HNO2S/c3-1(6)5-2(4)7;1-4(2)3/h(H5,3,4,5,6,7);1H.
What are the key properties of CID 174966153?
CID 174966153 has a molecular weight of 182.16 g/mol, XLogP of -1.64, 0 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for CID 174966153 is sourced from PubChem (CID 174966153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).