Basic information
- Standard SMILES
N#Cc1c(N2CCN(C(=O)c3cccs3)CC2)c2cccnc2n(Cc2ccccc2)c1=O- InChIKey
ZCGOHAYAKHIXSK-UHFFFAOYSA-N- Molecular formula
- C25H21N5O2S
- Average molar mass
- 455.5 g/mol
Names & identifiers
- Preferred name
- 1-Benzyl-2-oxo-4-[4-(thiophene-2-carbonyl)-piperazin-1-yl]-1,2-dihydro-[1,8]-naphthyridine-3-carbonitrile
- IUPAC
- 1-benzyl-2-oxo-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]-1,8-naphthyridine-3-carbonitrile
Names & synonyms
SCHEMBL4850922ZCGOHAYAKHIXSK-UHFFFAOYSA-N1-Benzyl-2-oxo-4-[4-(thiophene-2-carbonyl)-piperazin-1-yl]-1,2-dihydro-[1,8]-naphthyridine-3-carbonitrile
Database identifiers
- PubChem CID
- 11224837
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 837
Related reactions
1 records
Compound notes
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