Basic information
- CAS
69123-55-3- Standard SMILES
O=C(Nc1ccc(Cl)cc1)Nc1nccs1- InChIKey
KPRKVTCHPGWYQW-UHFFFAOYSA-N- Molecular formula
- C10H8ClN3OS
- Average molar mass
- 253.71 g/mol
- Monoisotopic mass
- 253.0076608
Names & identifiers
- Preferred name
- 1-(4-Chloro-phenyl)-3-thiazol-2-yl-urea
- IUPAC
- 1-(4-chlorophenyl)-3-(1,3-thiazol-2-yl)urea
Names & synonyms
1-(4-chlorophenyl)-3-(1,3-thiazol-2-yl)urea69123-55-31-(4-Chloro-phenyl)-3-thiazol-2-yl-ureaMLS000523574ZINC46014SMR000122647NSC291925N-(4-chlorophenyl)-N'-1,3-thiazol-2-ylureaOprea1_074118Oprea1_128916cid_324932CHEMBL1559362
Show more names
O=C(Nc1nccs1)Nc1ccc(cc1)ClBDBM76384DTXSID10315117HMS2361F10MFCD00554896STK019581ZINC00046014AKOS000484173
Database identifiers
- CAS
69123-55-3- PubChem CID
- 324932
- DTXSID
DTXSID10315117- ChEMBL
CHEMBL1559362- EC Number
- 188-659-1
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 82.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 246
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…