5H-Pyridazino(3,4-b)(1,4)benzoxazine, 8-amino-5-methyl-3-(4-methyl-1-piperazinyl)-
Basic information
- CAS
61939-70-6- Standard SMILES
CN1CCN(c2cc3c(nn2)Oc2cc(N)ccc2N3C)CC1- InChIKey
NGKLMHJPBKDIFN-UHFFFAOYSA-N- Molecular formula
- C16H20N6O
- Average molar mass
- 312.37 g/mol
- Monoisotopic mass
- 312.16985928
Names & identifiers
- Preferred name
- 5H-Pyridazino(3,4-b)(1,4)benzoxazine, 8-amino-5-methyl-3-(4-methyl-1-piperazinyl)-
- IUPAC
- 5-methyl-3-(4-methylpiperazin-1-yl)pyridazino[3,4-b][1,4]benzoxazin-8-amine
Names & synonyms
61939-70-6BRN 10905185H-Pyridazino(3,4-b)(1,4)benzoxazine, 8-amino-5-methyl-3-(4-methyl-1-piperazinyl)-DTXSID502109752-(4-Methylpiperazinyl-1)-7-amino-10-methyl-3,4-diazaphenoxazine8-Amino-5-methyl-3-(4-methyl-1-piperazinyl)-5H-pyridazino(3,4-b)(1,4)benzoxazineRefChem:305727DTXCID801334665-methyl-3-(4-methyl-1-piperazinyl)-5H-pyridazino[3,4-b][1,4]benzoxazin-8-amineCHEMBL4890795HMS3538N125-methyl-3-(4-methylpiperazin-1-yl)pyridazino[3,4-b][1,4]benzoxazin-8-amine
Show more names
AKOS005027861CCG-278932SDCCGSBI-0658840.P0015-methyl-3-(4-methylpiperazin-1-yl)-5H-pyridazino[3,4-b][1,4]benzoxazin-8-amine
Database identifiers
- CAS
61939-70-6- PubChem CID
- 6410488
- DTXSID
DTXSID50210975- ChEMBL
CHEMBL4890795- Nikkaji
- J78.838D
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 70.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 1
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 415
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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