Basic information
- Standard SMILES
Cl.Nc1ncc(CN2CCN(c3ccc(Cl)cc3)CC2)c(N)n1- InChIKey
YDSLLLDKLHYFKM-UHFFFAOYSA-N- Molecular formula
- C15H20Cl2N6
- Average molar mass
- 355.3 g/mol
Names & identifiers
- Preferred name
- 5-[4-(4-Chloro-phenyl)-piperazin-1-ylmethyl]-pyrimidine-2,4-diamine hydrochloride
- IUPAC
- 5-[[4-(4-chlorophenyl)piperazin-1-yl]methyl]pyrimidine-2,4-diamine;hydrochloride
Names & synonyms
SCHEMBL7813876YDSLLLDKLHYFKM-UHFFFAOYSA-N5-[4-(4-chloro-phenyl)-piperazin-1-ylmethyl]-pyrimidine-2,4-diamine hydrochloride
Database identifiers
- PubChem CID
- 21473688
Properties
Computed structural properties
- Topological polar surface area
- 84.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 341
Related reactions
1 records
Compound notes
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