n-[4-(4-Chlorophenyl)-1,3-thiazol-2-yl]thiophene-2-carboxamide

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Basic information

CAS: 6144-31-6
Standard SMILES: O=C(Nc1nc(-c2ccc(Cl)cc2)cs1)c1cccs1
InChIKey: QVQYSPHMYMXFBZ-UHFFFAOYSA-N
Molecular formula: C14H9ClN2OS2
Average molar mass: 320.8 g/mol
Monoisotopic mass: 319.984483

Names & identifiers

Preferred name: n-[4-(4-Chlorophenyl)-1,3-thiazol-2-yl]thiophene-2-carboxamide
IUPAC: N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]thiophene-2-carboxamide

Names & synonyms

n-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]thiophene-2-carboxamide307510-55-0N-(4-(4-chlorophenyl)thiazol-2-yl)thiophene-2-carboxamide6144-31-6CBMicro_001426Cambridge id 6144316DTXSID60977002SMSF0015185AKOS000660338CB03155BIM-0001570.P001F0098-0268

Database identifiers

CAS: 6144-31-6
PubChem CID: 727495
DTXSID: DTXSID60977002

Properties

Computed structural properties

XLogP: 4.4
Topological polar surface area: 98.5 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 3
Heavy atoms: 20
Formal charge: 0
Complexity: 350

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