(2-phenyl-1,3-thiazol-4-yl)urea

C10H9N3OS — CID 67551000

IUPAC(2-phenyl-1,3-thiazol-4-yl)urea
SMILESNC(=O)Nc1csc(-c2ccccc2)n1
InChIInChI=1S/C10H9N3OS/c11-10(14)13-8-6-15-9(12-8)7-4-2-1-3-5-7/h1-6H,(H3,11,13,14)
InChIKeyIEJANKDXAXHCGG-UHFFFAOYSA-N
MW219.27 g/mol
LogP2.30
Rot. Bonds2

About (2-phenyl-1,3-thiazol-4-yl)urea

(2-phenyl-1,3-thiazol-4-yl)urea (PubChem CID 67551000) has the molecular formula C10H9N3OS and a molecular weight of 219.27 g/mol. Its IUPAC name is (2-phenyl-1,3-thiazol-4-yl)urea.

Molecular Properties

Compound Name(2-phenyl-1,3-thiazol-4-yl)urea
PubChem CID67551000
Molecular FormulaC10H9N3OS
Molecular Weight219.27 g/mol
Exact Mass219.05
IUPAC Name(2-phenyl-1,3-thiazol-4-yl)urea
SMILESNC(=O)Nc1csc(-c2ccccc2)n1
InChIInChI=1S/C10H9N3OS/c11-10(14)13-8-6-15-9(12-8)7-4-2-1-3-5-7/h1-6H,(H3,11,13,14)
InChIKeyIEJANKDXAXHCGG-UHFFFAOYSA-N
XLogP2.30
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.27
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2-phenyl-1,3-thiazol-4-yl)urea?
The IUPAC name of (2-phenyl-1,3-thiazol-4-yl)urea (CID 67551000) is (2-phenyl-1,3-thiazol-4-yl)urea.
What is the SMILES notation for (2-phenyl-1,3-thiazol-4-yl)urea?
The canonical SMILES for (2-phenyl-1,3-thiazol-4-yl)urea is NC(=O)Nc1csc(-c2ccccc2)n1.
What is the InChIKey of (2-phenyl-1,3-thiazol-4-yl)urea?
The InChIKey is IEJANKDXAXHCGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3OS/c11-10(14)13-8-6-15-9(12-8)7-4-2-1-3-5-7/h1-6H,(H3,11,13,14).
What are the key properties of (2-phenyl-1,3-thiazol-4-yl)urea?
(2-phenyl-1,3-thiazol-4-yl)urea has a molecular weight of 219.27 g/mol, XLogP of 2.30, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-phenyl-1,3-thiazol-4-yl)urea is sourced from PubChem (CID 67551000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).