1-(4-Methylphenyl)-3-pyridin-4-ylurea
Basic information
- CAS
13256-77-4- Standard SMILES
Cc1ccc(NC(=O)Nc2ccncc2)cc1- InChIKey
POYXSENYDFATHJ-UHFFFAOYSA-N- Molecular formula
- C13H13N3O
- Average molar mass
- 227.26 g/mol
- Monoisotopic mass
- 227.10586205
Names & identifiers
- Preferred name
- 1-(4-Methylphenyl)-3-pyridin-4-ylurea
- IUPAC
- 1-(4-methylphenyl)-3-pyridin-4-ylurea
- English name
- Urea, N-(4-methylphenyl)-N'-4-pyridinyl-
- Molecular formula
- C13H13N3O
- Molecular weight
- 227.26182
Names & synonyms
1-(4-methylphenyl)-3-pyridin-4-ylurea13256-77-4ParaTUPpTUPOprea1_317458CHEMBL166999SCHEMBL5851814DTXSID90350369STK131911AKOS001219657N-(4-methylphenyl)-N'-(4-pyridinyl)ureaN-(4-Methylphenyl)-N'-(pyridin-4-yl)urea
Show more names
Urea, N-(4-methylphenyl)-N'-4-pyridinyl-
ST51029606N-(4-methylphenyl)(4-pyridylamino)carboxamideZ55292395
Database identifiers
- CAS
13256-77-4- PubChem CID
- 677338
- DTXSID
DTXSID90350369- ChEMBL
CHEMBL166999- Nikkaji
- J273.809K
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 54 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 243
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Related reactions
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Compound notes
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