Basic information
- Standard SMILES
Cc1nc2cc(Cl)c(-c3ccc(C(=O)Nc4ccccc4Cl)s3)cc2o1- InChIKey
GOPUDJORJSHVES-UHFFFAOYSA-N- Molecular formula
- C19H12Cl2N2O2S
- Average molar mass
- 403.3 g/mol
- Monoisotopic mass
- 401.9996542
Names & identifiers
- Preferred name
- [5-(5-chloro-2-methylbenzoxazol-6-yl)(2-thienyl)]-N-(2-chlorophenyl)carboxamide
- IUPAC
- 5-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)-N-(2-chlorophenyl)thiophene-2-carboxamide
Names & synonyms
CHEMBL3729771SCHEMBL10201121SCHEMBL29642114GOPUDJORJSHVES-UHFFFAOYSA-N[5-(5-chloro-2-methylbenzoxazol-6-yl)(2-thienyl)]-N-(2-chlorophenyl)carboxamide
Database identifiers
- PubChem CID
- 56847660
- ChEMBL
CHEMBL3729771
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 83.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 526
Related reactions
1 records
Compound notes
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