4-hydrazinylidene-7-methyl-3-(1,3-thiazol-4-yl)chromen-5-ol

C13H11N3O2S — CID 135789795

IUPAC4-hydrazinylidene-7-methyl-3-(1,3-thiazol-4-yl)chromen-5-ol
SMILESCc1cc(O)c2c(=NN)c(-c3cscn3)coc2c1
InChIInChI=1S/C13H11N3O2S/c1-7-2-10(17)12-11(3-7)18-4-8(13(12)16-14)9-5-19-6-15-9/h2-6,17H,14H2,1H3
InChIKeyUSWLZRLROVXUDT-UHFFFAOYSA-N
MW273.32 g/mol
LogP2.34
Rot. Bonds1

About 4-hydrazinylidene-7-methyl-3-(1,3-thiazol-4-yl)chromen-5-ol

4-hydrazinylidene-7-methyl-3-(1,3-thiazol-4-yl)chromen-5-ol (PubChem CID 135789795) has the molecular formula C13H11N3O2S and a molecular weight of 273.32 g/mol. Its IUPAC name is 4-hydrazinylidene-7-methyl-3-(1,3-thiazol-4-yl)chromen-5-ol.

Molecular Properties

Compound Name4-hydrazinylidene-7-methyl-3-(1,3-thiazol-4-yl)chromen-5-ol
PubChem CID135789795
Molecular FormulaC13H11N3O2S
Molecular Weight273.32 g/mol
Exact Mass273.06
IUPAC Name4-hydrazinylidene-7-methyl-3-(1,3-thiazol-4-yl)chromen-5-ol
SMILESCc1cc(O)c2c(=NN)c(-c3cscn3)coc2c1
InChIInChI=1S/C13H11N3O2S/c1-7-2-10(17)12-11(3-7)18-4-8(13(12)16-14)9-5-19-6-15-9/h2-6,17H,14H2,1H3
InChIKeyUSWLZRLROVXUDT-UHFFFAOYSA-N
XLogP2.34
TPSA84.64 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.32
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-hydrazinylidene-7-methyl-3-(1,3-thiazol-4-yl)chromen-5-ol?
The IUPAC name of 4-hydrazinylidene-7-methyl-3-(1,3-thiazol-4-yl)chromen-5-ol (CID 135789795) is 4-hydrazinylidene-7-methyl-3-(1,3-thiazol-4-yl)chromen-5-ol.
What is the SMILES notation for 4-hydrazinylidene-7-methyl-3-(1,3-thiazol-4-yl)chromen-5-ol?
The canonical SMILES for 4-hydrazinylidene-7-methyl-3-(1,3-thiazol-4-yl)chromen-5-ol is Cc1cc(O)c2c(=NN)c(-c3cscn3)coc2c1.
What is the InChIKey of 4-hydrazinylidene-7-methyl-3-(1,3-thiazol-4-yl)chromen-5-ol?
The InChIKey is USWLZRLROVXUDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3O2S/c1-7-2-10(17)12-11(3-7)18-4-8(13(12)16-14)9-5-19-6-15-9/h2-6,17H,14H2,1H3.
What are the key properties of 4-hydrazinylidene-7-methyl-3-(1,3-thiazol-4-yl)chromen-5-ol?
4-hydrazinylidene-7-methyl-3-(1,3-thiazol-4-yl)chromen-5-ol has a molecular weight of 273.32 g/mol, XLogP of 2.34, 1 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinylidene-7-methyl-3-(1,3-thiazol-4-yl)chromen-5-ol is sourced from PubChem (CID 135789795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).