Basic information
- CAS
485339-54-6- Standard SMILES
CC(C)NC(=S)Nc1ccc(N=Nc2ccccc2)cc1- InChIKey
RIOCEISAFIJLHN-UHFFFAOYSA-N- Molecular formula
- C16H18N4S
- Average molar mass
- 298.4 g/mol
- Monoisotopic mass
- 298.12521776
Names & identifiers
- Preferred name
- Thiourea, N-(1-methylethyl)-N'-[4-(2-phenyldiazenyl)phenyl]-
- IUPAC
- 1-(4-phenyldiazenylphenyl)-3-propan-2-ylthiourea
Names & synonyms
DTXSID501040199Thiourea, N-(1-methylethyl)-N'-[4-(2-phenyldiazenyl)phenyl]-AKOS003713896485339-54-6
Database identifiers
- CAS
485339-54-6- PubChem CID
- 7940656
- DTXSID
DTXSID501040199
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 80.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 342
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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