beta-(Pyrazolyl-1)-Ala(2)-Thyrotropin-Releasing Hormone
[CAS# 28398-28-9]

Identification

• Name: beta-(Pyrazolyl-1)-Ala(2)-Thyrotropin-Releasing Hormone
• Synonyms: (2S)-N-[(1S)-2-[(2S)-2-Carbamoylpyrrolidin-1-Yl]-2-Oxo-1-(2H-Pyrazol-3-Ylmethyl)Ethyl]-5-Oxo-Pyrrolidine-2-Carboxamide; (2S)-N-[(1S)-2-[(2S)-2-Carbamoyl-1-Pyrrolidinyl]-2-Oxo-1-(2H-Pyrazol-3-Ylmethyl)Ethyl]-5-Oxo-2-Pyrrolidinecarboxamide; (2S)-N-[(1S)-2-[(2S)-2-Carbamoylpyrrolidin-1-Yl]-2-Keto-1-(2H-Pyrazol-3-Ylmethyl)Ethyl]-5-Keto-Pyrrolidine-2-Carboxamide
• Molecular Formula: C₁₆H₂₂N₆O₄
• Molecular Weight: 362.39
• CAS Registry Number: 28398-28-9
• SMILES: [C@H]1(CCC(N1)=O)C(=O)N[C@H](C(N2CCC[C@H]2C(N)=O)=O)CC3=CC=N[NH]3
• InChI: 1S/C16H22N6O4/c17-14(24)12-2-1-7-22(12)16(26)11(8-9-5-6-18-21-9)20-15(25)10-3-4-13(23)19-10/h5-6,10-12H,1-4,7-8H2,(H2,17,24)(H,18,21)(H,19,23)(H,20,25)/t10-,11-,12-/m0/s1
• InChIKey: YMUAIJKCQCFCKS-SRVKXCTJSA-N

Properties

• Density: 1.422g/cm³ (Cal.)
• Boiling point: 941.117°C at 760 mmHg (Cal.)
• Flash point: 522.969°C (Cal.)