[7-(3-methoxy-1-methylpyrazol-4-yl)-1,5-naphthyridin-2-yl]-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)tin

C18H18N6OSSn — CID 144666001

IUPAC[7-(3-methoxy-1-methylpyrazol-4-yl)-1,5-naphthyridin-2-yl]-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)tin
SMILESCOc1nn(C)cc1-c1cnc2ccc([Sn]c3nnc(C(C)C)s3)nc2c1
InChIInChI=1S/C13H11N4O.C5H7N2S.Sn/c1-17-8-10(13(16-17)18-2)9-6-12-11(15-7-9)4-3-5-14-12;1-4(2)5-7-6-3-8-5;/h3-4,6-8H,1-2H3;4H,1-2H3;
InChIKeyPXLWDSLODANGLE-UHFFFAOYSA-N
MW485.16 g/mol
LogP1.67
Rot. Bonds5

About [7-(3-methoxy-1-methylpyrazol-4-yl)-1,5-naphthyridin-2-yl]-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)tin

[7-(3-methoxy-1-methylpyrazol-4-yl)-1,5-naphthyridin-2-yl]-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)tin (PubChem CID 144666001) has the molecular formula C18H18N6OSSn and a molecular weight of 485.16 g/mol. Its IUPAC name is [7-(3-methoxy-1-methylpyrazol-4-yl)-1,5-naphthyridin-2-yl]-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)tin.

Molecular Properties

Compound Name[7-(3-methoxy-1-methylpyrazol-4-yl)-1,5-naphthyridin-2-yl]-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)tin
PubChem CID144666001
Molecular FormulaC18H18N6OSSn
Molecular Weight485.16 g/mol
Exact Mass486.03
IUPAC Name[7-(3-methoxy-1-methylpyrazol-4-yl)-1,5-naphthyridin-2-yl]-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)tin
SMILESCOc1nn(C)cc1-c1cnc2ccc([Sn]c3nnc(C(C)C)s3)nc2c1
InChIInChI=1S/C13H11N4O.C5H7N2S.Sn/c1-17-8-10(13(16-17)18-2)9-6-12-11(15-7-9)4-3-5-14-12;1-4(2)5-7-6-3-8-5;/h3-4,6-8H,1-2H3;4H,1-2H3;
InChIKeyPXLWDSLODANGLE-UHFFFAOYSA-N
XLogP1.67
TPSA78.61 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500485.16
LogP ≤ 51.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze [7-(3-methoxy-1-methylpyrazol-4-yl)-1,5-naphthyridin-2-yl]-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)tin with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [7-(3-methoxy-1-methylpyrazol-4-yl)-1,5-naphthyridin-2-yl]-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)tin?
The IUPAC name of [7-(3-methoxy-1-methylpyrazol-4-yl)-1,5-naphthyridin-2-yl]-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)tin (CID 144666001) is [7-(3-methoxy-1-methylpyrazol-4-yl)-1,5-naphthyridin-2-yl]-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)tin.
What is the SMILES notation for [7-(3-methoxy-1-methylpyrazol-4-yl)-1,5-naphthyridin-2-yl]-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)tin?
The canonical SMILES for [7-(3-methoxy-1-methylpyrazol-4-yl)-1,5-naphthyridin-2-yl]-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)tin is COc1nn(C)cc1-c1cnc2ccc([Sn]c3nnc(C(C)C)s3)nc2c1.
What is the InChIKey of [7-(3-methoxy-1-methylpyrazol-4-yl)-1,5-naphthyridin-2-yl]-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)tin?
The InChIKey is PXLWDSLODANGLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N4O.C5H7N2S.Sn/c1-17-8-10(13(16-17)18-2)9-6-12-11(15-7-9)4-3-5-14-12;1-4(2)5-7-6-3-8-5;/h3-4,6-8H,1-2H3;4H,1-2H3;.
What are the key properties of [7-(3-methoxy-1-methylpyrazol-4-yl)-1,5-naphthyridin-2-yl]-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)tin?
[7-(3-methoxy-1-methylpyrazol-4-yl)-1,5-naphthyridin-2-yl]-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)tin has a molecular weight of 485.16 g/mol, XLogP of 1.67, 5 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [7-(3-methoxy-1-methylpyrazol-4-yl)-1,5-naphthyridin-2-yl]-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)tin is sourced from PubChem (CID 144666001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).