N-(6-Methoxy-5-(1-methyl-1H-pyrazol-4-yl)pyridin-2-yl)-3,4-dimethyl-2-(4-methylthiazol-2-yl)-2,3,4,5-tetrahydropyrido[3,2-f][1,4]oxazepin-8-amine
Basic information
- Standard SMILES
COc1nc(Nc2ccc3c(n2)OC(c2nc(C)cs2)C(C)N(C)C3)ccc1-c1cnn(C)c1- InChIKey
CGQWYXSIJYVSTP-UHFFFAOYSA-N- Molecular formula
- C24H27N7O2S
- Average molar mass
- 477.6 g/mol
- Monoisotopic mass
- 477.1946943
Names & identifiers
- Preferred name
- N-(6-Methoxy-5-(1-methyl-1H-pyrazol-4-yl)pyridin-2-yl)-3,4-dimethyl-2-(4-methylthiazol-2-yl)-2,3,4,5-tetrahydropyrido[3,2-f][1,4]oxazepin-8-amine
- IUPAC
- N-[6-methoxy-5-(1-methylpyrazol-4-yl)-2-pyridinyl]-3,4-dimethyl-2-(4-methyl-1,3-thiazol-2-yl)-3,5-dihydro-2H-pyrido[3,2-f][1,4]oxazepin-8-amine
Names & synonyms
SCHEMBL3708909CGQWYXSIJYVSTP-UHFFFAOYSA-NN-(6-Methoxy-5-(1-methyl-1H-pyrazol-4-yl)pyridin-2-yl)-3,4-dimethyl-2-(4-methylthiazol-2-yl)-2,3,4,5-tetrahydropyrido[3,2-f][1,4]oxazepin-8-amine
Database identifiers
- PubChem CID
- 57512840
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 118 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 5
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 677
Related reactions
1 records
Compound notes
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