Basic information
- CAS
24050-97-3- Standard SMILES
COc1cc(CNc2nc(-c3ccccc3)cs2)cc(OC)c1OC- InChIKey
QCXRCNJZQOUKCJ-UHFFFAOYSA-N- Molecular formula
- C19H20N2O3S
- Average molar mass
- 356.4 g/mol
- Monoisotopic mass
- 356.11946368
Names & identifiers
- Preferred name
- Thiazole, 4-phenyl-2-(3,4,5-trimethoxybenzylamino)-
- IUPAC
- 4-phenyl-N-[(3,4,5-trimethoxyphenyl)methyl]-1,3-thiazol-2-amine
- English name
- 4-Phenyl-2-[(3,4,5-trimethoxybenzyl)amino]thiazole
- Molecular formula
- C19H20N2O3S
- Molecular weight
- 356.44
Names & synonyms
BRN 115877624050-97-3Thiazole, 4-phenyl-2-(3,4,5-trimethoxybenzylamino)-4-Phenyl-2-(3,4,5-trimethoxybenzylamino)thiazoleDTXSID80178796RefChem:384576DTXCID401012874-phenyl-N-[(3,4,5-trimethoxyphenyl)methyl]-1,3-thiazol-2-amine4-Phenyl-2-[(3,4,5-trimethoxybenzyl)amino]thiazole2-Thiazolamine, 4-phenyl-N-[(3,4,5-trimethoxyphenyl)methyl]-
Database identifiers
- CAS
24050-97-3- PubChem CID
- 212293
- DTXSID
DTXSID80178796- Nikkaji
- J48.800C
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 80.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 381
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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