8-amino-9-fluoro-3-methyl-10-[(3-cyclopropylaminomethyl)-1-pyrrolidinyl]-7-oxo-2,3-dihydro-7H-pyrido[1,2,3-de][1,4]benzoxazine-6-carboxylic acid
Basic information
- Standard SMILES
CC1COc2c(N3CCCC3CNC3CC3)c(F)c(N)c3c(=O)c(C(=O)O)cn1c23- InChIKey
WGRIPLMRJSNPAX-UHFFFAOYSA-N- Molecular formula
- C21H25FN4O4
- Average molar mass
- 416.4 g/mol
Names & identifiers
- Preferred name
- 8-amino-9-fluoro-3-methyl-10-[(3-cyclopropylaminomethyl)-1-pyrrolidinyl]-7-oxo-2,3-dihydro-7H-pyrido[1,2,3-de][1,4]benzoxazine-6-carboxylic acid
- IUPAC
- 8-amino-6-[2-[(cyclopropylamino)methyl]pyrrolidin-1-yl]-7-fluoro-2-methyl-10-oxo-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraene-11-carboxylic acid
Names & synonyms
SCHEMBL9687942WGRIPLMRJSNPAX-UHFFFAOYSA-N8-amino-9-fluoro-3-methyl-10-[(3-cyclopropylaminomethyl)-1-pyrrolidinyl]-7-oxo-2,3-dihydro-7H-pyrido[1,2,3-de][1,4]benzoxazine-6-carboxylic acid
Database identifiers
- PubChem CID
- 67906313
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 759
Related reactions
2 records
Compound notes
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