Basic information
- Standard SMILES
O=C(c1cccs1)N(CCCN1CCOCC1)c1nc(-c2cccc(Cl)c2)cs1- InChIKey
JGFZUZXCOFSCOP-UHFFFAOYSA-N- Molecular formula
- C21H22ClN3O2S2
- Average molar mass
- 448 g/mol
- Monoisotopic mass
- 447.084197
Names & identifiers
- Preferred name
- N-(4-(3-Chlorophenyl)thiazol-2-yl)-N-(3-morpholinopropyl)thiophene-2-carboxamide
- IUPAC
- N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]-N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide
Names & synonyms
SCHEMBL2829399JGFZUZXCOFSCOP-UHFFFAOYSA-NN-(4-(3-Chlorophenyl)thiazol-2-yl)-N-(3-morpholinopropyl)thiophene-2-carboxamide
Database identifiers
- PubChem CID
- 68407178
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 538
Related reactions
2 records
Compound notes
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