Urea, N-[[4-[4-(hydroxymethyl)-1-piperidinyl]phenyl]methyl]-N'-[4-(2-phenyldiazenyl)phenyl]-
Basic information
- CAS
1390932-27-0- Standard SMILES
O=C(NCc1ccc(N2CCC(CO)CC2)cc1)Nc1ccc(N=Nc2ccccc2)cc1- InChIKey
VBUDMNITTWTTDV-UHFFFAOYSA-N- Molecular formula
- C26H29N5O2
- Average molar mass
- 443.5 g/mol
- Monoisotopic mass
- 443.23212518
Names & identifiers
- Preferred name
- Urea, N-[[4-[4-(hydroxymethyl)-1-piperidinyl]phenyl]methyl]-N'-[4-(2-phenyldiazenyl)phenyl]-
- IUPAC
- 1-[[4-[4-(hydroxymethyl)piperidin-1-yl]phenyl]methyl]-3-(4-phenyldiazenylphenyl)urea
Names & synonyms
DTXSID701040652AKOS0087221431390932-27-0Urea, N-[[4-[4-(hydroxymethyl)-1-piperidinyl]phenyl]methyl]-N'-[4-(2-phenyldiazenyl)phenyl]-
Database identifiers
- CAS
1390932-27-0- PubChem CID
- 60486372
- DTXSID
DTXSID701040652
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 89.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 600
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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