7-[(1S,5R)-6-[[(2S)-2-[[(2S)-2-Aminopropanoyl]Amino]Propanoyl]Amino]-3-Azabicyclo[3.1.0]Hexan-3-Yl]-1-(2,4-Difluorophenyl)-6-Fluoro-4-Oxo-1,8-Naphthyridine-3-Carboxylic Acid
[CAS# 157182-32-6]

Identification

• Name: 7-[(1S,5R)-6-[[(2S)-2-[[(2S)-2-Aminopropanoyl]Amino]Propanoyl]Amino]-3-Azabicyclo[3.1.0]Hexan-3-Yl]-1-(2,4-Difluorophenyl)-6-Fluoro-4-Oxo-1,8-Naphthyridine-3-Carboxylic Acid
• Synonyms: 7-[(1S,5R)-6-[[(2S)-2-[[(2S)-2-Amino-1-Oxopropyl]Amino]-1-Oxopropyl]Amino]-3-Azabicyclo[3.1.0]Hexan-3-Yl]-1-(2,4-Difluorophenyl)-6-Fluoro-4-Oxo-1,8-Naphthyridine-3-Carboxylic Acid; 7-[(1S,5R)-6-[[(2S)-2-(Alanylamino)Propanoyl]Amino]-3-Azabicyclo[3.1.0]Hexan-3-Yl]-1-(2,4-Difluorophenyl)-6-Fluoro-4-Keto-1,8-Naphthyridine-3-Carboxylic Acid; L-Alaninamide, L-Alanyl-N-(3-(6-Carboxy-8-(2,4-Difluorophenyl)-3-Fluoro-5,8-Dihydro-5-Oxo-1,8-Naphthyridin-2-Yl)-3-Azabicyclo(3.1.0)Hex-6-Yl)-, (1Alpha,5Alpha,6Alpha)-
• Molecular Formula: C₂₆H₂₅F₃N₆O₅
• Molecular Weight: 558.52
• CAS Registry Number: 157182-32-6
• SMILES: [C@@H]12[C@@H](C1NC(=O)[C@@H](NC(=O)[C@@H](N)C)C)CN(C2)C3=C(F)C=C4C(=N3)N(C=C(C4=O)C(O)=O)C5=C(F)C=C(F)C=C5
• InChI: 1S/C26H25F3N6O5/c1-10(30)24(37)31-11(2)25(38)32-20-14-7-34(8-15(14)20)23-18(29)6-13-21(36)16(26(39)40)9-35(22(13)33-23)19-4-3-12(27)5-17(19)28/h3-6,9-11,14-15,20H,7-8,30H2,1-2H3,(H,31,37)(H,32,38)(H,39,40)/t10-,11-,14-,15+,20?/m0/s1
• InChIKey: UUZPPAMZDFLUHD-LZGARRQBSA-N

Properties

• Density: 1.573g/cm³ (Cal.)
• Boiling point: 863.167°C at 760 mmHg (Cal.)
• Flash point: 475.826°C (Cal.)