CID 173148384

C10H24AlN4O4S2 — CID 173148384

IUPAC—
SMILESCS(=O)(=O)N1CCN([Al]N2CCN(S(C)(=O)=O)CC2)CC1.[H][H]
InChIInChI=1S/2C5H11N2O2S.Al.H2/c2*1-10(8,9)7-4-2-6-3-5-7;;/h2*2-5H2,1H3;;1H/q2*-1;+2;
InChIKeyFRDWBYJLNIZFMP-UHFFFAOYSA-N
MW355.44 g/mol
LogP-2.08
Rot. Bonds4

About CID 173148384

CID 173148384 (PubChem CID 173148384) has the molecular formula C10H24AlN4O4S2 and a molecular weight of 355.44 g/mol.

Molecular Properties

Compound NameCID 173148384
PubChem CID173148384
Molecular FormulaC10H24AlN4O4S2
Molecular Weight355.44 g/mol
Exact Mass355.11
IUPAC Name—
SMILESCS(=O)(=O)N1CCN([Al]N2CCN(S(C)(=O)=O)CC2)CC1.[H][H]
InChIInChI=1S/2C5H11N2O2S.Al.H2/c2*1-10(8,9)7-4-2-6-3-5-7;;/h2*2-5H2,1H3;;1H/q2*-1;+2;
InChIKeyFRDWBYJLNIZFMP-UHFFFAOYSA-N
XLogP-2.08
TPSA81.24 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 5-2.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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CID 173148383
CID 173148383
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Frequently Asked Questions

What is the IUPAC name of CID 173148384?
The IUPAC name of CID 173148384 (CID 173148384) is not available.
What is the SMILES notation for CID 173148384?
The canonical SMILES for CID 173148384 is CS(=O)(=O)N1CCN([Al]N2CCN(S(C)(=O)=O)CC2)CC1.[H][H].
What is the InChIKey of CID 173148384?
The InChIKey is FRDWBYJLNIZFMP-UHFFFAOYSA-N. The full InChI is InChI=1S/2C5H11N2O2S.Al.H2/c2*1-10(8,9)7-4-2-6-3-5-7;;/h2*2-5H2,1H3;;1H/q2*-1;+2;.
What are the key properties of CID 173148384?
CID 173148384 has a molecular weight of 355.44 g/mol, XLogP of -2.08, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173148384 is sourced from PubChem (CID 173148384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).