4H-1-Benzopyran-4-one, 3-(2-amino-4-thiazolyl)-2,6-dimethyl-
Basic information
- CAS
104819-36-5- Standard SMILES
Cc1ccc2oc(C)c(-c3csc(N)n3)c(=O)c2c1- InChIKey
RFOZQYVMHLVABJ-UHFFFAOYSA-N- Molecular formula
- C14H12N2O2S
- Average molar mass
- 272.32 g/mol
- Monoisotopic mass
- 272.0619488
Names & identifiers
- Preferred name
- 4H-1-Benzopyran-4-one, 3-(2-amino-4-thiazolyl)-2,6-dimethyl-
- IUPAC
- 3-(2-amino-1,3-thiazol-4-yl)-2,6-dimethylchromen-4-one
- English name
- Chromone, 3-(2-aminothiazol-4-yl)-2,6-dimethyl-
- Molecular weight
- 0
Names & synonyms
104819-36-5BRN 55727614H-1-BENZOPYRAN-4-ONE, 3-(2-AMINO-4-THIAZOLYL)-2,6-DIMETHYL-Chromone, 3-(2-aminothiazol-4-yl)-2,6-dimethyl-3-(2-Amino-4-thiazolyl)-2,6-dimethyl-4H-1-benzopyran-4-oneDTXSID70146762RefChem:297290DTXCID50692533-(2-Aminothiazol-4-yl)-2,6-dimethyl-4H-chromen-4-one3-(2-amino-1,3-thiazol-4-yl)-2,6-dimethyl-4h-chromen-4-one3-(2-amino-1,3-thiazol-4-yl)-2,6-dimethylchromen-4-one3-(2-Amino-1,3-thiazol-4-yl)-2,6-dimethyl-4H-1-benzopyran-4-one
Database identifiers
- CAS
104819-36-5- PubChem CID
- 59898
- DTXSID
DTXSID70146762
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 93.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 424
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Related reactions
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Compound notes
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