CID 87288357

C7H7N2OSSn — CID 87288357

IUPAC—
SMILESO=C1CCCN1c1ncc([Sn])s1
InChIInChI=1S/C7H7N2OS.Sn/c10-6-2-1-4-9(6)7-8-3-5-11-7;/h3H,1-2,4H2;
InChIKeySHLXUUDSYYKDOQ-UHFFFAOYSA-N
MW285.92 g/mol
LogP0.06
Rot. Bonds1

About CID 87288357

CID 87288357 (PubChem CID 87288357) has the molecular formula C7H7N2OSSn and a molecular weight of 285.92 g/mol.

Molecular Properties

Compound NameCID 87288357
PubChem CID87288357
Molecular FormulaC7H7N2OSSn
Molecular Weight285.92 g/mol
Exact Mass286.93
IUPAC Name—
SMILESO=C1CCCN1c1ncc([Sn])s1
InChIInChI=1S/C7H7N2OS.Sn/c10-6-2-1-4-9(6)7-8-3-5-11-7;/h3H,1-2,4H2;
InChIKeySHLXUUDSYYKDOQ-UHFFFAOYSA-N
XLogP0.06
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.92
LogP ≤ 50.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of CID 87288357?
The IUPAC name of CID 87288357 (CID 87288357) is not available.
What is the SMILES notation for CID 87288357?
The canonical SMILES for CID 87288357 is O=C1CCCN1c1ncc([Sn])s1.
What is the InChIKey of CID 87288357?
The InChIKey is SHLXUUDSYYKDOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N2OS.Sn/c10-6-2-1-4-9(6)7-8-3-5-11-7;/h3H,1-2,4H2;.
What are the key properties of CID 87288357?
CID 87288357 has a molecular weight of 285.92 g/mol, XLogP of 0.06, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 87288357 is sourced from PubChem (CID 87288357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).