Basic information
- Standard SMILES
Cc1nc(-c2ccccc2)c(C(=O)N2C(C)CCCC2CN)s1- InChIKey
LFVLVPLILWLMMD-UHFFFAOYSA-N- Molecular formula
- C18H23N3OS
- Average molar mass
- 329.5 g/mol
Names & identifiers
- Preferred name
- (2-(Aminomethyl)-6-methylpiperidin-1-yl)(2-methyl-4-phenylthiazol-5-yl)methanone
- IUPAC
- [2-(aminomethyl)-6-methylpiperidin-1-yl]-(2-methyl-4-phenyl-1,3-thiazol-5-yl)methanone
Names & synonyms
SCHEMBL15174181LFVLVPLILWLMMD-UHFFFAOYSA-NDB-131244(2-(aminomethyl)-6-methylpiperidin-1-yl)(2-methyl-4-phenylthiazol-5-yl)methanone[2-(Aminomethyl)-6-methyl-1-piperidinyl](2-methyl-4-phenyl-5-thiazolyl)methanonerac-(2-(aminomethyl)-6-methylpiperidin-1-yl)(2-methyl-4-phenylthiazol-5-yl)methanone1450633-77-8
Database identifiers
- PubChem CID
- 89739675
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 87.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 413
Related reactions
1 records
Compound notes
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