Basic information
- CAS
144881-35-6- Standard SMILES
NC1=NCC(CN2CCN(c3ccc(Cl)cc3)CC2)O1- InChIKey
SAFNJPRIKYBKQZ-UHFFFAOYSA-N- Molecular formula
- C14H19ClN4O
- Average molar mass
- 294.78 g/mol
- Monoisotopic mass
- 294.1247389
Names & identifiers
- Preferred name
- 5-((4-(4-Chlorophenyl)-1-piperazinyl)methyl)-4,5-dihydro-2-oxazolamine
- IUPAC
- 5-[[4-(4-chlorophenyl)piperazin-1-yl]methyl]-4,5-dihydro-1,3-oxazol-2-amine
Names & synonyms
144881-35-65-((4-(4-Chlorophenyl)-1-piperazinyl)methyl)-4,5-dihydro-2-oxazolamine5-[[4-(4-Chlorophenyl)-1-piperazinyl]methyl]-4,5-dihydro-2-oxazolamineRefChem:1072309BRN 54464774,5-Dihydro-5-((4-(4-chlorophenyl)-1-piperazinyl)methyl)-2-oxazolamine2-Oxazolamine, 4,5-dihydro-5-((4-(4-chlorophenyl)-1-piperazinyl)methyl)-DTXSID409324322-Oxazolamine, 5-((4-(4-chlorophenyl)-1-piperazinyl)methyl)-4,5-dihydro-5-{[4-(4-chlorophenyl)piperazin-1-yl]methyl}-4,5-dihydro-1,3-oxazol-2-amine
Database identifiers
- CAS
144881-35-6- PubChem CID
- 86249
- DTXSID
DTXSID40932432- Nikkaji
- J1.598.754E
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 54.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 349
Experimental & physicochemical properties
LogP1.71
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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