Basic information
- Standard SMILES
CCCOc1ccc(CCl)cc1-c1nc2c(CCC)nn(C)c2c(=O)[nH]1- InChIKey
ZSNVNEXGACYLSR-UHFFFAOYSA-N- Molecular formula
- C19H23ClN4O2
- Average molar mass
- 374.9 g/mol
Names & identifiers
- Preferred name
- 5-(5-Chloromethyl-2-n-propoxyphenyl)-1-methyl-3-n-propyl-1,6-dihydro-7H-pyrazolo-[4,3-d]pyrimidin-7-one
- IUPAC
- 5-[5-(chloromethyl)-2-propoxyphenyl]-1-methyl-3-propyl-6H-pyrazolo[4,5-d]pyrimidin-7-one
Names & synonyms
SCHEMBL7960910ZSNVNEXGACYLSR-UHFFFAOYSA-N5-(5-Chloromethyl-2-n-propoxyphenyl)-1-methyl-3-n-propyl-1,6-dihydro-7H-pyrazolo-[4,3-d]pyrimidin-7-one5-(5-chloromethyl-2-n-propoxyphenyl)-1-methyl-3-n-propyl-1,6-dihydro-7H-pyrazolo[4,3-d]-pyrimidin-7-one5-(5-chloromethyl-2-n-propoxyphenyl)-1-methyl-3-n-propyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Database identifiers
- PubChem CID
- 136116209
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 68.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 530
Related reactions
22 records
Compound notes
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