5-(1,1-dioxido-1,2-thiazinan-2-yl)-N-(4-fluorobenzyl)-8-hydroxy-1,6-naphthyridine-7-carboxamide

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Basic information

CAS: 410544-95-5
Standard SMILES: O=C(NCc1ccc(F)cc1)c1nc(N2CCCCS2(=O)=O)c2cccnc2c1O
InChIKey: DIDKWCOCQJWMDJ-UHFFFAOYSA-N
Molecular formula: C20H19FN4O4S
Average molar mass: 430.5 g/mol
Monoisotopic mass: 430.11110444

Names & identifiers

Preferred name: 5-(1,1-dioxido-1,2-thiazinan-2-yl)-N-(4-fluorobenzyl)-8-hydroxy-1,6-naphthyridine-7-carboxamide
IUPAC: 5-(1,1-dioxothiazinan-2-yl)-N-[(4-fluorophenyl)methyl]-8-hydroxy-1,6-naphthyridine-7-carboxamide

Names & synonyms

410544-95-5L-870810L 8708105-(1,1-dioxido-1,2-thiazinan-2-yl)-N-(4-fluorobenzyl)-8-hydroxy-1,6-naphthyridine-7-carboxamideUNII-6TXL33ZFOP6TXL33ZFOPL-870,8105-(1,1-dioxothiazinan-2-yl)-N-[(4-fluorophenyl)methyl]-8-hydroxy-1,6-naphthyridine-7-carboxamide5-DTF-HNCCHEMBL4148501,6-Naphthyridine-7-carboxamide, N-[(4-fluorophenyl)methyl]-8-hydroxy-5-(tetrahydro-1,1-dioxido-2H-1,2-thiazin-2-yl)-1,6-Naphthyridine-7-carboxamide, N-((4-fluorophenyl)methyl)-8-hydroxy-5-(tetrahydro-1,1-dioxido-2H-1,2-thiazin-2-yl)-

Show more names

L-000870810410545-86-7orb1703176SCHEMBL1198641SCHEMBL29393055BDBM23402DTXSID10194025DIDKWCOCQJWMDJ-UHFFFAOYSA-N

Database identifiers

CAS: 410544-95-5
PubChem CID: 457930
DTXSID: DTXSID10194025
ChEMBL: CHEMBL414850
UNII: 6TXL33ZFOP

Properties

Computed structural properties

XLogP: 2.5
Topological polar surface area: 121 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 8
Rotatable bonds: 4
Heavy atoms: 30
Formal charge: 0
Complexity: 710

Related reactions

1 records

New reaction record

HRID 897316As productuspto-grants-2005_07

Compound notes

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