2-Thiazolamine, N-methyl-4-(4-nitrophenyl)-
Basic information
- CAS
91260-88-7- Standard SMILES
CNc1nc(-c2ccc([N+](=O)[O-])cc2)cs1- InChIKey
HXAVFNKEMFPELQ-UHFFFAOYSA-N- Molecular formula
- C10H9N3O2S
- Average molar mass
- 235.26 g/mol
- Monoisotopic mass
- 235.04154771
Names & identifiers
- Preferred name
- 2-Thiazolamine, N-methyl-4-(4-nitrophenyl)-
- IUPAC
- N-methyl-4-(4-nitrophenyl)-1,3-thiazol-2-amine
Names & synonyms
91260-88-72-Thiazolamine, N-methyl-4-(4-nitrophenyl)-DTXSID60340010RefChem:267257DTXCID40291091N-Methyl-4-(4-nitrophenyl)-1,3-thiazol-2-amineN-methyl-4-(4-nitrophenyl)thiazol-2-amine4-{4-nitrophenyl}-2-(methylamino)-1,3-thiazoleMLS000545686Oprea1_708920CHEMBL1517530SCHEMBL12643697
Show more names
HMS2300N23AKOS001321694N-methyl-4-nitrophenyl-2-thiazolamineSMR000162677DB-096798AB-601/30965014A1-27337Z48861048
Database identifiers
- CAS
91260-88-7- PubChem CID
- 560762
- DTXSID
DTXSID60340010- ChEMBL
CHEMBL1517530- Nikkaji
- J2.332.684A
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 99 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 251
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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