4-Pyrimidinamine, N-2-cyclopenten-1-yl-2-(4-(3,3,3-triphenylpropyl)-1-piperazinyl)-
Basic information
- CAS
36524-62-6- Standard SMILES
C1=CC(Nc2ccnc(N3CCN(CCC(c4ccccc4)(c4ccccc4)c4ccccc4)CC3)n2)CC1- InChIKey
SMRVVXSZFVJHGS-UHFFFAOYSA-N- Molecular formula
- C34H37N5
- Average molar mass
- 515.7 g/mol
- Monoisotopic mass
- 515.3048962
Names & identifiers
- Preferred name
- 4-Pyrimidinamine, N-2-cyclopenten-1-yl-2-(4-(3,3,3-triphenylpropyl)-1-piperazinyl)-
- IUPAC
- N-cyclopent-2-en-1-yl-2-[4-(3,3,3-triphenylpropyl)piperazin-1-yl]pyrimidin-4-amine
Names & synonyms
BRN 0734829N-2-Cyclopenten-1-yl-2-(4-(3,3,3-triphenylpropyl)-1-piperazinyl)-4-pyrimidinamine36524-62-65-25-12-00028 (Beilstein Handbook Reference)4-Pyrimidinamine, N-2-cyclopenten-1-yl-2-(4-(3,3,3-triphenylpropyl)-1-piperazinyl)-RefChem:296103DTXSID20957825N-(Cyclopent-2-en-1-yl)-2-[4-(3,3,3-triphenylpropyl)piperazin-1-yl]pyrimidin-4(3H)-imine
Database identifiers
- CAS
36524-62-6- PubChem CID
- 215862
- DTXSID
DTXSID20957825
Properties
Computed structural properties
- XLogP
- 7.3
- Topological polar surface area
- 44.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 697
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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