Basic information
- CAS
23937-98-6- Standard SMILES
COc1cccc(CNc2nc(-c3ccccc3)cs2)c1OC- InChIKey
GSVJXMATAFZFSO-UHFFFAOYSA-N- Molecular formula
- C18H18N2O2S
- Average molar mass
- 326.4 g/mol
- Monoisotopic mass
- 326.10889899
Names & identifiers
- Preferred name
- Thiazole, 2-(2,3-dimethoxybenzylamino)-4-phenyl-
- IUPAC
- N-[(2,3-dimethoxyphenyl)methyl]-4-phenyl-1,3-thiazol-2-amine
- English name
- 2-[(2,3-Dimethoxybenzyl)amino]-4-phenylthiazole
- Molecular formula
- C18H18N2O2S
- Molecular weight
- 326.41
Names & synonyms
2-(2,3-Dimethoxybenzylamino)-4-phenylthiazole23937-98-6BRN 1151590Thiazole, 2-(2,3-dimethoxybenzylamino)-4-phenyl-RefChem:384499N-[(2,3-dimethoxyphenyl)methyl]-4-phenyl-1,3-thiazol-2-amine2-[(2,3-Dimethoxybenzyl)amino]-4-phenylthiazole2-((2,3-Dimethoxybenzyl)amino)-4-phenylthiazoleDTXSID40946756N-[(2,3-Dimethoxyphenyl)methyl]-4-phenyl-1,3-thiazol-2(3H)-imine2-Thiazolamine, N-[(2,3-dimethoxyphenyl)methyl]-4-phenyl-
Database identifiers
- CAS
23937-98-6- PubChem CID
- 212124
- DTXSID
DTXSID40946756- Nikkaji
- J48.795C
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 71.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 352
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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