Basic information
- CAS
6964-41-6- Standard SMILES
Oc1ccccc1C1N(Cc2ccc(Cl)cc2)CCCN1Cc1ccc(Cl)cc1- InChIKey
CEWMWTSOOOAHPL-UHFFFAOYSA-N- Molecular formula
- C24H24Cl2N2O
- Average molar mass
- 427.4 g/mol
- Monoisotopic mass
- 426.1265688
Names & identifiers
- Preferred name
- 2-[1,3-Bis[(4-chlorophenyl)methyl]-1,3-diazinan-2-yl]phenol
- IUPAC
- 2-[1,3-bis[(4-chlorophenyl)methyl]-1,3-diazinan-2-yl]phenol
Names & synonyms
2-[1,3-bis[(4-chlorophenyl)methyl]-1,3-diazinan-2-yl]phenol6964-41-62-{1,3-Bis[(4-chlorophenyl)methyl]-1,3-diazinan-2-yl}phenolNSC67947DTXSID60328914NSC-67947
Database identifiers
- CAS
6964-41-6- PubChem CID
- 415249
- DTXSID
DTXSID60328914
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 26.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 459
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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