1-(3-Methoxyphenyl)-3-phenylthiourea
Basic information
- CAS
31090-81-0- Standard SMILES
COc1cccc(NC(=S)Nc2ccccc2)c1- InChIKey
QZSMRTKLSHKPEV-UHFFFAOYSA-N- Molecular formula
- C14H14N2OS
- Average molar mass
- 258.34 g/mol
- Monoisotopic mass
- 258.08268425
Names & identifiers
- Preferred name
- 1-(3-Methoxyphenyl)-3-phenylthiourea
- IUPAC
- 1-(3-methoxyphenyl)-3-phenylthiourea
Names & synonyms
1-(3-methoxyphenyl)-3-phenylthioureaZINC5550372[(3-methoxyphenyl)amino](phenylamino)methane-1-thioneN-(3-methoxyphenyl)-N'-phenylthioureaNSC1914253-MethoxythiocarbanilideTimTec1_001492Oprea1_4859623METHOXYTHIOCARBANILIDECOc1cccc(c1)NC(=S)Nc1ccccc1DTXSID50351357HMS1538D18
Show more names
MFCD00444417SBB006327STK047958ZINC05550372AKOS000487694N(3METHOXYPHENYL)NPHENYLTHIOUREANSC-1914251(3METHOXYPHENYL)3PHENYLTHIOUREA
Database identifiers
- CAS
31090-81-0、3129-54-2- PubChem CID
- 698360
- DTXSID
DTXSID50351357
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 65.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 267
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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