Thiourea, N-(4-fluorophenyl)-N'-(4-(3-(4-phenyl-1-piperazinyl)propoxy)phenyl)-
Basic information
- CAS
85868-74-2- Standard SMILES
Fc1ccc(NC(=S)Nc2ccc(OCCCN3CCN(c4ccccc4)CC3)cc2)cc1- InChIKey
GPHAVJXMJRCZHR-UHFFFAOYSA-N- Molecular formula
- C26H29FN4OS
- Average molar mass
- 464.6 g/mol
- Monoisotopic mass
- 464.2046109
Names & identifiers
- Preferred name
- Thiourea, N-(4-fluorophenyl)-N'-(4-(3-(4-phenyl-1-piperazinyl)propoxy)phenyl)-
- IUPAC
- 1-(4-fluorophenyl)-3-[4-[3-(4-phenylpiperazin-1-yl)propoxy]phenyl]thiourea
Names & synonyms
BRN 4606169Thiourea, N-(4-fluorophenyl)-N'-(4-(3-(4-phenyl-1-piperazinyl)propoxy)phenyl)-85868-74-2N-(4-Fluorophenyl)-N'-(4-(3-(4-phenyl-1-piperazinyl)propoxy)phenyl)thioureaDTXSID00235178RefChem:385504DTXCID00157669N-(4-Fluorophenyl)-N'-{4-[3-(4-phenylpiperazin-1-yl)propoxy]phenyl}thiourea
Database identifiers
- CAS
85868-74-2- PubChem CID
- 3070145
- DTXSID
DTXSID00235178
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 71.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 567
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Compound notes
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