3-[2,6-Di(Propan-2-Yl)Phenyl]-1-[(2S)-2-(1-Methylindol-3-Yl)Hexyl]Urea
[CAS# 145131-63-1]

Identification

• Name: 3-[2,6-Di(Propan-2-Yl)Phenyl]-1-[(2S)-2-(1-Methylindol-3-Yl)Hexyl]Urea
• Synonyms: 3-(2,6-Diisopropylphenyl)-1-[(2S)-2-(1-Methylindol-3-Yl)Hexyl]Urea; 3-(2,6-Diisopropylphenyl)-1-[(2S)-2-(1-Methyl-3-Indolyl)Hexyl]Urea; (+)-N(Sup 1)-(2,6-Diisopropylphenyl)-N(Sup 2)-(2-(1-Methyl-3-Indolyl)Hexyl)Urea
• Molecular Formula: C₂₈H₃₉N₃O
• Molecular Weight: 433.64
• CAS Registry Number: 145131-63-1
• SMILES: [C@H](CNC(NC1=C(C=CC=C1C(C)C)C(C)C)=O)(CCCC)C2=C[N](C3=C2C=CC=C3)C
• InChI: 1S/C28H39N3O/c1-7-8-12-21(25-18-31(6)26-16-10-9-13-24(25)26)17-29-28(32)30-27-22(19(2)3)14-11-15-23(27)20(4)5/h9-11,13-16,18-21H,7-8,12,17H2,1-6H3,(H2,29,30,32)/t21-/m1/s1
• InChIKey: RTINIKMXELNHKC-OAQYLSRUSA-N

Properties

• Density: 1.058g/cm³ (Cal.)
• Boiling point: 554.072°C at 760 mmHg (Cal.)
• Flash point: 288.892°C (Cal.)