Chemical Compound

SCHEMBL3141318

CAS Registry Number210353-53-0
SCHEMBL3141318 chemical structure
Primary record

SCHEMBL3141318

CAS
210353-53-0
PubChem CID
87484908
SMILES
CO/N=C\1/CN(CC1CN)C2=C(C=C3C(=O)C(=CN(C3=N2)C4CC4)C(=O)OS(=O)(=O)C)F
Molecular Formula
C19H22FN5O6S
Molecular Weight
467.479
Exact Mass
467.1275
InChI
InChI=1S/C19H22FN5O6S/c1-30-23-15-9-24(7-10(15)6-21)18-14(20)5-12-16(26)13(19(27)31-32(2,28)29)8-25(11-3-4-11)17(12)22-18/h5,8,10-11H,3-4,6-7,9,21H2,1-2H3/b23-15-
InChIKey
JKSJLCXIAFVTRF-HAHDFKILSA-N
LogP
0.3842
TPSA
146.18

Names and synonyms

  • SCHEMBL3141318
  • 1,8-Naphthyridine-3-carboxylic acid, 7-[(4Z)-3-(aminomethyl)-4-(methoxyimino)-1-pyrrolidinyl]-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-, monomethanesulfonate
  • 210353-53-0