Basic information
- CAS
76167-83-4- Standard SMILES
CN(c1ncc(Cc2cnc(N(C)C3CCN(Cc4ccccc4)CC3)nc2)cn1)C1CCN(Cc2ccccc2)CC1- InChIKey
PQGBSUMSPYTOOR-UHFFFAOYSA-N- Molecular formula
- C35H44N8
- Average molar mass
- 576.8 g/mol
- Monoisotopic mass
- 576.36889344
Names & identifiers
- Preferred name
- 5,5'-Methylenebis(N-methyl-N-(1-(phenylmethyl)-4-piperidinyl)-2-pyrimidinamine
- IUPAC
- N-(1-benzylpiperidin-4-yl)-5-[[2-[(1-benzylpiperidin-4-yl)-methylamino]pyrimidin-5-yl]methyl]-N-methylpyrimidin-2-amine
Names & synonyms
V2BR6UD7VE76167-83-4Pyrimidine, 5,5'-methylenebis(2-(N-(1-benzyl-4-piperidyl)methylamino)-NSC 350004UNII-V2BR6UD7VENSC-350004DTXSID802270315,5'-Methylenebis(2-(N-(1-benzyl-4-piperidyl)methylamino)pyrimidine)Bis(2-(N-methyl-N-(1'-benzyl-4'-piperidyl))amino-5-pyrimidyl)methane5,5'-Methylenebis(N-methyl-N-(1-(phenylmethyl)-4-piperidinyl)-2-pyrimidinamineRefChem:198808DTXCID80149522
Show more names
NSC350004IMB-3505,5'-Methylenebis[N-(1-benzylpiperidin-4-yl)-N-methylpyrimidin-2-amine]N-(1-benzyl-4-piperidyl)-5-[[2-[(1-benzyl-4-piperidyl)-methyl-amino]pyrimidin-5-yl]methyl]-N-methyl-pyrimidin-2-amine
Database identifiers
- CAS
76167-83-4- PubChem CID
- 100700
- DTXSID
DTXSID80227031- UNII
- V2BR6UD7VE
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 64.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 10
- Heavy atoms
- 43
- Formal charge
- 0
- Complexity
- 705
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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