N-[2-[(4-methylphenyl)carbamoyl]phenyl]thiophene-2-carboxamide
Basic information
- CAS
6044-37-7- Standard SMILES
Cc1ccc(NC(=O)c2ccccc2NC(=O)c2cccs2)cc1- InChIKey
PTEHINZKKXGQHR-UHFFFAOYSA-N- Molecular formula
- C19H16N2O2S
- Average molar mass
- 336.4 g/mol
- Monoisotopic mass
- 336.09324893
Names & identifiers
- Preferred name
- N-[2-[(4-methylphenyl)carbamoyl]phenyl]thiophene-2-carboxamide
- IUPAC
- N-[2-[(4-methylphenyl)carbamoyl]phenyl]thiophene-2-carboxamide
Names & synonyms
6044-37-7N-[2-[(4-methylphenyl)carbamoyl]phenyl]thiophene-2-carboxamideN-{2-[(4-methylphenyl)carbamoyl]phenyl}thiophene-2-carboxamideThiophene-2-carboxylic acid (2-p-tolylcarbamoyl-phenyl)-amideCBMicro_009974Oprea1_433562Oprea1_535175MLS001217518CHEMBL1333717DTXSID20352316HMS2892D12SMSF0012061
Show more names
STK063322AKOS000602354CB12869SMR000607600ST015688BIM-0010017.P001N-(4-methylphenyl)[2-(2-thienylcarbonylamino)phenyl]carboxamideN-(2-{[(4-methylphenyl)amino]carbonyl}phenyl)-2-thiophenecarboxamide
Database identifiers
- CAS
6044-37-7- PubChem CID
- 722976
- DTXSID
DTXSID20352316- ChEMBL
CHEMBL1333717
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 86.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 449
Experimental & physicochemical properties
Solubility<0.4 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…