(Z)-1-(2,6-dichlorophenyl)-N-(1,3-thiazol-2-yl)methanimine

C10H6Cl2N2S — CID 122714082

IUPAC(Z)-1-(2,6-dichlorophenyl)-N-(1,3-thiazol-2-yl)methanimine
SMILESClc1cccc(Cl)c1C=Nc1nccs1
InChIInChI=1S/C10H6Cl2N2S/c11-8-2-1-3-9(12)7(8)6-14-10-13-4-5-15-10/h1-6H
InChIKeySIKPWTYPVIKBGX-UHFFFAOYSA-N
MW257.15 g/mol
LogP4.20
Rot. Bonds2

About (Z)-1-(2,6-dichlorophenyl)-N-(1,3-thiazol-2-yl)methanimine

(Z)-1-(2,6-dichlorophenyl)-N-(1,3-thiazol-2-yl)methanimine (PubChem CID 122714082) has the molecular formula C10H6Cl2N2S and a molecular weight of 257.15 g/mol. Its IUPAC name is (Z)-1-(2,6-dichlorophenyl)-N-(1,3-thiazol-2-yl)methanimine.

Molecular Properties

Compound Name(Z)-1-(2,6-dichlorophenyl)-N-(1,3-thiazol-2-yl)methanimine
PubChem CID122714082
Molecular FormulaC10H6Cl2N2S
Molecular Weight257.15 g/mol
Exact Mass255.96
IUPAC Name(Z)-1-(2,6-dichlorophenyl)-N-(1,3-thiazol-2-yl)methanimine
SMILESClc1cccc(Cl)c1C=Nc1nccs1
InChIInChI=1S/C10H6Cl2N2S/c11-8-2-1-3-9(12)7(8)6-14-10-13-4-5-15-10/h1-6H
InChIKeySIKPWTYPVIKBGX-UHFFFAOYSA-N
XLogP4.20
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.15
LogP ≤ 54.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-1-(2,6-dichlorophenyl)-N-(1,3-thiazol-2-yl)methanimine?
The IUPAC name of (Z)-1-(2,6-dichlorophenyl)-N-(1,3-thiazol-2-yl)methanimine (CID 122714082) is (Z)-1-(2,6-dichlorophenyl)-N-(1,3-thiazol-2-yl)methanimine.
What is the SMILES notation for (Z)-1-(2,6-dichlorophenyl)-N-(1,3-thiazol-2-yl)methanimine?
The canonical SMILES for (Z)-1-(2,6-dichlorophenyl)-N-(1,3-thiazol-2-yl)methanimine is Clc1cccc(Cl)c1C=Nc1nccs1.
What is the InChIKey of (Z)-1-(2,6-dichlorophenyl)-N-(1,3-thiazol-2-yl)methanimine?
The InChIKey is SIKPWTYPVIKBGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Cl2N2S/c11-8-2-1-3-9(12)7(8)6-14-10-13-4-5-15-10/h1-6H.
What are the key properties of (Z)-1-(2,6-dichlorophenyl)-N-(1,3-thiazol-2-yl)methanimine?
(Z)-1-(2,6-dichlorophenyl)-N-(1,3-thiazol-2-yl)methanimine has a molecular weight of 257.15 g/mol, XLogP of 4.20, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-(2,6-dichlorophenyl)-N-(1,3-thiazol-2-yl)methanimine is sourced from PubChem (CID 122714082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).