2-[(4S)-5-(4-Tert-Butylpiperidin-1-Yl)-4-[(5-Dimethylaminonaphthalen-1-Yl)Sulfonylamino]-5-Oxopentyl]Guanidine
[CAS# 72561-48-9]

Identification

• Name: 2-[(4S)-5-(4-Tert-Butylpiperidin-1-Yl)-4-[(5-Dimethylaminonaphthalen-1-Yl)Sulfonylamino]-5-Oxopentyl]Guanidine
• Synonyms: 2-[(4S)-5-(4-Tert-Butyl-1-Piperidyl)-4-[(5-Dimethylamino-1-Naphthyl)Sulfonylamino]-5-Oxo-Pentyl]Guanidine; 2-[(4S)-5-(4-Tert-Butyl-1-Piperidinyl)-4-[(5-Dimethylamino-1-Naphthyl)Sulfonylamino]-5-Oxopentyl]Guanidine; 2-[(4S)-5-(4-Tert-Butyl-1-Piperidyl)-4-[(5-Dimethylamino-1-Naphthyl)Sulfonylamino]-5-Keto-Pentyl]Guanidine
• Molecular Formula: C₂₇H₄₂N₆O₃S
• Molecular Weight: 530.73
• CAS Registry Number: 72561-48-9 (74133-53-2)
• SMILES: [C@@H](N[S](=O)(=O)C1=CC=CC2=C1C=CC=C2N(C)C)(C(=O)N3CCC(C(C)(C)C)CC3)CCCN=C(N)N
• InChI: 1S/C27H42N6O3S/c1-27(2,3)19-14-17-33(18-15-19)25(34)22(11-8-16-30-26(28)29)31-37(35,36)24-13-7-9-20-21(24)10-6-12-23(20)32(4)5/h6-7,9-10,12-13,19,22,31H,8,11,14-18H2,1-5H3,(H4,28,29,30)/t22-/m0/s1
• InChIKey: WWQLRAHPSLWIDR-QFIPXVFZSA-N

Properties

• Density: 1.251g/cm³ (Cal.)
• Boiling point: 727.927°C at 760 mmHg (Cal.)
• Flash point: 394.036°C (Cal.)