Basic information
- CAS
5837-47-8- Standard SMILES
CCCNC(=O)c1c(NC(=O)c2cccc(C)c2)sc2c1CCCC2- InChIKey
DKCXEHRZDSYWIG-UHFFFAOYSA-N- Molecular formula
- C20H24N2O2S
- Average molar mass
- 356.5 g/mol
- Monoisotopic mass
- 356.15584919
Names & identifiers
- Preferred name
- 2-[(3-methylbenzoyl)amino]-N-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
- IUPAC
- 2-[(3-methylbenzoyl)amino]-N-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Names & synonyms
5837-47-8STK0756312-(3-METHYLBENZAMIDO)-N-PROPYL-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXAMIDE2-[(3-methylbenzoyl)amino]-N-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamideCBMicro_049534Oprea1_738173DTXSID00367842DKCXEHRZDSYWIG-UHFFFAOYSA-NAKOS0016563302-[(3-methylbenzoyl)amino]-N-propyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamideBIM-0049356.P001SR-01000462346
Show more names
SR-01000462346-12-{[(3-methylphenyl)carbonyl]amino}-N-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Database identifiers
- CAS
5837-47-8- PubChem CID
- 2298643
- DTXSID
DTXSID00367842
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 86.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 484
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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