1-(4-Methoxybenzyl)-5-({(2S)-2-[(3-pyridinyloxy)methyl]-1-pyrrolidinyl}sulfonyl)-1H-indole-2,3-dione
[CAS# 872254-32-5]

Identification

• Name: 1-(4-Methoxybenzyl)-5-({(2S)-2-[(3-pyridinyloxy)methyl]-1-pyrrolidinyl}sulfonyl)-1H-indole-2,3-dione
• Synonyms: (S)-1-(4-methoxybenzyl)-5-(2-(pyridin-3-yl-oxymethyl)-pyrrolidine-1-sulfonyl)-1H-indole-2,3-dione; 1-(4-Methyoxybenzyl)-5-(2-(pyridin-3-yl-oxymethyl)-pyrrolidine-1-sulfonyl)-1H-indole-2,3-dione; NSCI
• Molecular Formula: C₂₆H₂₅N₃O₆S
• Molecular Weight: 507.56
• CAS Registry Number: 872254-32-5
• SMILES: COC1=CC=C(C=C1)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CCC[C@H]4COC5=CN=CC=C5)C(=O)C2=O
• InChI: 1S/C26H25N3O6S/c1-34-20-8-6-18(7-9-20)16-28-24-11-10-22(14-23(24)25(30)26(28)31)36(32,33)29-13-3-4-19(29)17-35-21-5-2-12-27-15-21/h2,5-12,14-15,19H,3-4,13,16-17H2,1H3/t19-/m0/s1
• InChIKey: XDHJBIYJRNFDKS-IBGZPJMESA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Boiling point: 732.1±70.0°C at 760 mmHg (Cal.)
• Flash point: 396.6±35.7°C (Cal.)
• Refractive index: 1.642 (Cal.)