tris[(2-naphthalen-2-ylacetyl)oxy]stannyl 2-naphthalen-2-ylacetate

C48H36O8Sn — CID 141032751

IUPACtris[(2-naphthalen-2-ylacetyl)oxy]stannyl 2-naphthalen-2-ylacetate
SMILESO=C(Cc1ccc2ccccc2c1)O[Sn](OC(=O)Cc1ccc2ccccc2c1)(OC(=O)Cc1ccc2ccccc2c1)OC(=O)Cc1ccc2ccccc2c1
InChIInChI=1S/4C12H10O2.Sn/c4*13-12(14)8-9-5-6-10-3-1-2-4-11(10)7-9;/h4*1-7H,8H2,(H,13,14);/q;;;;+4/p-4
InChIKeyRWFWOWFPZHDXCK-UHFFFAOYSA-J
MW859.52 g/mol
LogP9.18
Rot. Bonds12

About tris[(2-naphthalen-2-ylacetyl)oxy]stannyl 2-naphthalen-2-ylacetate

tris[(2-naphthalen-2-ylacetyl)oxy]stannyl 2-naphthalen-2-ylacetate (PubChem CID 141032751) has the molecular formula C48H36O8Sn and a molecular weight of 859.52 g/mol. Its IUPAC name is tris[(2-naphthalen-2-ylacetyl)oxy]stannyl 2-naphthalen-2-ylacetate.

Molecular Properties

Compound Nametris[(2-naphthalen-2-ylacetyl)oxy]stannyl 2-naphthalen-2-ylacetate
PubChem CID141032751
Molecular FormulaC48H36O8Sn
Molecular Weight859.52 g/mol
Exact Mass860.14
IUPAC Nametris[(2-naphthalen-2-ylacetyl)oxy]stannyl 2-naphthalen-2-ylacetate
SMILESO=C(Cc1ccc2ccccc2c1)O[Sn](OC(=O)Cc1ccc2ccccc2c1)(OC(=O)Cc1ccc2ccccc2c1)OC(=O)Cc1ccc2ccccc2c1
InChIInChI=1S/4C12H10O2.Sn/c4*13-12(14)8-9-5-6-10-3-1-2-4-11(10)7-9;/h4*1-7H,8H2,(H,13,14);/q;;;;+4/p-4
InChIKeyRWFWOWFPZHDXCK-UHFFFAOYSA-J
XLogP9.18
TPSA105.20 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds12
Heavy Atoms57
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500859.52
LogP ≤ 59.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze tris[(2-naphthalen-2-ylacetyl)oxy]stannyl 2-naphthalen-2-ylacetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

iodo 2-naphthalen-2-ylacetate
CID 129274840
CID 162695032
CID 162695032
2-naphthalen-2-ylacetic acid;hydrate
CID 141284527
sodium 2-naphthalen-2-ylacetate
CID 23688045
CID 173442082
CID 173442082
trimethyl-[2-(2-naphthalen-2-ylacetyl)oxyethyl]azanium
CID 15225296
(4-acetylphenyl) 2-naphthalen-2-ylacetate
CID 8764059
3-naphthalen-2-yl-2-oxopropanamide
CID 57061050
[2-(carbamoylamino)-2-oxoethyl] 2-naphthalen-2-ylacetate
CID 7828580
2-(2-methylprop-2-enyl)naphthalene
CID 24722193
2-(2-naphthalen-2-ylacetyl)oxyethyl 2-methylprop-2-enoate
CID 101047899
N-[3,5-bis[(2-naphthalen-2-ylacetyl)amino]phenyl]-2-naphthalen-2-ylacetamide
CID 67257199

Frequently Asked Questions

What is the IUPAC name of tris[(2-naphthalen-2-ylacetyl)oxy]stannyl 2-naphthalen-2-ylacetate?
The IUPAC name of tris[(2-naphthalen-2-ylacetyl)oxy]stannyl 2-naphthalen-2-ylacetate (CID 141032751) is tris[(2-naphthalen-2-ylacetyl)oxy]stannyl 2-naphthalen-2-ylacetate.
What is the SMILES notation for tris[(2-naphthalen-2-ylacetyl)oxy]stannyl 2-naphthalen-2-ylacetate?
The canonical SMILES for tris[(2-naphthalen-2-ylacetyl)oxy]stannyl 2-naphthalen-2-ylacetate is O=C(Cc1ccc2ccccc2c1)O[Sn](OC(=O)Cc1ccc2ccccc2c1)(OC(=O)Cc1ccc2ccccc2c1)OC(=O)Cc1ccc2ccccc2c1.
What is the InChIKey of tris[(2-naphthalen-2-ylacetyl)oxy]stannyl 2-naphthalen-2-ylacetate?
The InChIKey is RWFWOWFPZHDXCK-UHFFFAOYSA-J. The full InChI is InChI=1S/4C12H10O2.Sn/c4*13-12(14)8-9-5-6-10-3-1-2-4-11(10)7-9;/h4*1-7H,8H2,(H,13,14);/q;;;;+4/p-4.
What are the key properties of tris[(2-naphthalen-2-ylacetyl)oxy]stannyl 2-naphthalen-2-ylacetate?
tris[(2-naphthalen-2-ylacetyl)oxy]stannyl 2-naphthalen-2-ylacetate has a molecular weight of 859.52 g/mol, XLogP of 9.18, 12 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for tris[(2-naphthalen-2-ylacetyl)oxy]stannyl 2-naphthalen-2-ylacetate is sourced from PubChem (CID 141032751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).