2,5-Dimethyl-furan-3-carboxylic acid [3-((4R,5R)-2-amino-5-fluoro-4-methyl-5,6-dihydro-4H-[1,3]oxazin-4-yl)-4-fluoro-phenyl]-amide

HCID 66559189
Substructure searchFind similar structures

Basic information

Standard SMILES
Cc1cc(C(=O)Nc2ccc(F)c([C@@]3(C)N=C(N)OC[C@@H]3F)c2)c(C)o1
InChIKey
OHCOXMADQMWRFQ-MAUKXSAKSA-N
Molecular formula
C18H19F2N3O3
Average molar mass
363.4 g/mol
Monoisotopic mass
363.1394478

Names & identifiers

Preferred name
2,5-Dimethyl-furan-3-carboxylic acid [3-((4R,5R)-2-amino-5-fluoro-4-methyl-5,6-dihydro-4H-[1,3]oxazin-4-yl)-4-fluoro-phenyl]-amide
IUPAC
N-[3-[(4R,5R)-2-amino-5-fluoro-4-methyl-5,6-dihydro-1,3-oxazin-4-yl]-4-fluorophenyl]-2,5-dimethylfuran-3-carboxamide

Names & synonyms

CHEMBL3680870SCHEMBL13194252OHCOXMADQMWRFQ-MAUKXSAKSA-NBDBM124148US8754075, 182,5-Dimethyl-furan-3-carboxylic acid [3-((4R,5R)-2-amino-5-fluoro-4-methyl-5,6-dihydro-4H-[1,3]oxazin-4-yl)-4-fluoro-phenyl]-amide

Database identifiers

PubChem CID
66559189
ChEMBL
CHEMBL3680870

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
89.9 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
3
Heavy atoms
26

Related reactions

2 records
New reaction record

Linked notes

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