N-[4-(Benzyloxy)-2-chlorophenyl]thiourea
Basic information
- CAS
117174-85-3- Standard SMILES
NC(=S)Nc1ccc(OCc2ccccc2)cc1Cl- InChIKey
SWWHORHRRWXCDA-UHFFFAOYSA-N- Molecular formula
- C14H13ClN2OS
- Average molar mass
- 292.8 g/mol
- Monoisotopic mass
- 292.0437119
Names & identifiers
- Preferred name
- N-[4-(Benzyloxy)-2-chlorophenyl]thiourea
- IUPAC
- (2-chloro-4-phenylmethoxyphenyl)thiourea
Names & synonyms
DTXSID501255762N-[4-(Benzyloxy)-2-chlorophenyl]thioureaN-[2-Chloro-4-(phenylmethoxy)phenyl]thiourea117174-85-3
Database identifiers
- CAS
117174-85-3- PubChem CID
- 85568167
- DTXSID
DTXSID501255762
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 79.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 297
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Compound notes
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