3-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]chromen-2-imine

C19H14N2O2S — CID 911710

IUPAC3-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]chromen-2-imine
SMILES[H]/N=c1\oc2ccccc2cc1-c1nc(-c2ccc(OC)cc2)cs1
InChIInChI=1S/C19H14N2O2S/c1-22-14-8-6-12(7-9-14)16-11-24-19(21-16)15-10-13-4-2-3-5-17(13)23-18(15)20/h2-11,20H,1H3/b20-18-
InChIKeyWZPKIPXIOLOHFM-ZZEZOPTASA-N
MW334.40 g/mol
LogP4.71
Rot. Bonds3

About 3-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]chromen-2-imine

3-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]chromen-2-imine (PubChem CID 911710) has the molecular formula C19H14N2O2S and a molecular weight of 334.40 g/mol. Its IUPAC name is 3-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]chromen-2-imine.

Molecular Properties

Compound Name3-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]chromen-2-imine
PubChem CID911710
Molecular FormulaC19H14N2O2S
Molecular Weight334.40 g/mol
Exact Mass334.08
IUPAC Name3-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]chromen-2-imine
SMILES[H]/N=c1\oc2ccccc2cc1-c1nc(-c2ccc(OC)cc2)cs1
InChIInChI=1S/C19H14N2O2S/c1-22-14-8-6-12(7-9-14)16-11-24-19(21-16)15-10-13-4-2-3-5-17(13)23-18(15)20/h2-11,20H,1H3/b20-18-
InChIKeyWZPKIPXIOLOHFM-ZZEZOPTASA-N
XLogP4.71
TPSA59.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.40
LogP ≤ 54.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]chromen-2-imine 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 3-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]chromen-2-imine?
The IUPAC name of 3-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]chromen-2-imine (CID 911710) is 3-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]chromen-2-imine.
What is the SMILES notation for 3-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]chromen-2-imine?
The canonical SMILES for 3-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]chromen-2-imine is [H]/N=c1\oc2ccccc2cc1-c1nc(-c2ccc(OC)cc2)cs1.
What is the InChIKey of 3-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]chromen-2-imine?
The InChIKey is WZPKIPXIOLOHFM-ZZEZOPTASA-N. The full InChI is InChI=1S/C19H14N2O2S/c1-22-14-8-6-12(7-9-14)16-11-24-19(21-16)15-10-13-4-2-3-5-17(13)23-18(15)20/h2-11,20H,1H3/b20-18-.
What are the key properties of 3-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]chromen-2-imine?
3-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]chromen-2-imine has a molecular weight of 334.40 g/mol, XLogP of 4.71, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]chromen-2-imine is sourced from PubChem (CID 911710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).