Basic information
- CAS
6237-68-9- Standard SMILES
Cc1ccnc(NC(=O)c2sc3ccccc3c2Cl)c1- InChIKey
YGVSITNXBOVTTQ-UHFFFAOYSA-N- Molecular formula
- C15H11ClN2OS
- Average molar mass
- 302.8 g/mol
- Monoisotopic mass
- 302.0280618
Names & identifiers
- Preferred name
- 3-chloro-N-(4-methylpyridin-2-yl)-1-benzothiophene-2-carboxamide
- IUPAC
- 3-chloro-N-(4-methyl-2-pyridinyl)-1-benzothiophene-2-carboxamide
Names & synonyms
3-chloro-N-(4-methylpyridin-2-yl)-1-benzothiophene-2-carboxamide6237-68-93-CHLORO-N-(4-METHYL-2-PYRIDINYL)-1-BENZOTHIOPHENE-2-CARBOXAMIDESMR000177492CBMicro_002399Oprea1_123933Oprea1_857316MLS000560368CHEMBL1567738DTXSID30977918HMS2560N11SMSF0018192
Show more names
STK8738553-Chloro-benzo[b]thiophene-2-carboxylic acid (4-methyl-pyridin-2-yl)-amideAKOS000532147CB03946CCG-111970BIM-0002422.P001SR-01000493094SR-01000493094-1
Database identifiers
- CAS
6237-68-9- PubChem CID
- 698273
- DTXSID
DTXSID30977918- ChEMBL
CHEMBL1567738
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 70.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 368
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…