2-[(4-phenyl-1,3-thiazol-2-yl)amino]phenol

C15H12N2OS — CID 15567360

IUPAC2-[(4-phenyl-1,3-thiazol-2-yl)amino]phenol
SMILESOc1ccccc1Nc1nc(-c2ccccc2)cs1
InChIInChI=1S/C15H12N2OS/c18-14-9-5-4-8-12(14)16-15-17-13(10-19-15)11-6-2-1-3-7-11/h1-10,18H,(H,16,17)
InChIKeyQMCYXBBXXIHQSM-UHFFFAOYSA-N
MW268.34 g/mol
LogP4.26
Rot. Bonds3

About 2-[(4-phenyl-1,3-thiazol-2-yl)amino]phenol

2-[(4-phenyl-1,3-thiazol-2-yl)amino]phenol (PubChem CID 15567360) has the molecular formula C15H12N2OS and a molecular weight of 268.34 g/mol. Its IUPAC name is 2-[(4-phenyl-1,3-thiazol-2-yl)amino]phenol.

Molecular Properties

Compound Name2-[(4-phenyl-1,3-thiazol-2-yl)amino]phenol
PubChem CID15567360
Molecular FormulaC15H12N2OS
Molecular Weight268.34 g/mol
Exact Mass268.07
IUPAC Name2-[(4-phenyl-1,3-thiazol-2-yl)amino]phenol
SMILESOc1ccccc1Nc1nc(-c2ccccc2)cs1
InChIInChI=1S/C15H12N2OS/c18-14-9-5-4-8-12(14)16-15-17-13(10-19-15)11-6-2-1-3-7-11/h1-10,18H,(H,16,17)
InChIKeyQMCYXBBXXIHQSM-UHFFFAOYSA-N
XLogP4.26
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.34
LogP ≤ 54.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-phenyl-1,3-thiazol-2-yl)amino]phenol?
The IUPAC name of 2-[(4-phenyl-1,3-thiazol-2-yl)amino]phenol (CID 15567360) is 2-[(4-phenyl-1,3-thiazol-2-yl)amino]phenol.
What is the SMILES notation for 2-[(4-phenyl-1,3-thiazol-2-yl)amino]phenol?
The canonical SMILES for 2-[(4-phenyl-1,3-thiazol-2-yl)amino]phenol is Oc1ccccc1Nc1nc(-c2ccccc2)cs1.
What is the InChIKey of 2-[(4-phenyl-1,3-thiazol-2-yl)amino]phenol?
The InChIKey is QMCYXBBXXIHQSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2OS/c18-14-9-5-4-8-12(14)16-15-17-13(10-19-15)11-6-2-1-3-7-11/h1-10,18H,(H,16,17).
What are the key properties of 2-[(4-phenyl-1,3-thiazol-2-yl)amino]phenol?
2-[(4-phenyl-1,3-thiazol-2-yl)amino]phenol has a molecular weight of 268.34 g/mol, XLogP of 4.26, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-phenyl-1,3-thiazol-2-yl)amino]phenol is sourced from PubChem (CID 15567360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).