(2S)-2-[[4-[1-(2-Amino-4-Oxo-1H-Quinazolin-6-Yl)-3-Oxopropan-2-Yl]Benzoyl]Amino]Pentanedioic Acid
[CAS# 143436-91-3]

Identification

• Name: (2S)-2-[[4-[1-(2-Amino-4-Oxo-1H-Quinazolin-6-Yl)-3-Oxopropan-2-Yl]Benzoyl]Amino]Pentanedioic Acid
• Synonyms: (2S)-2-[[4-[1-[(2-Amino-4-Oxo-1H-Quinazolin-6-Yl)Methyl]-2-Oxo-Ethyl]Benzoyl]Amino]Pentanedioic Acid; (2S)-2-[[[4-[1-[(2-Amino-4-Oxo-1H-Quinazolin-6-Yl)Methyl]-2-Oxoethyl]Phenyl]-Oxomethyl]Amino]Pentanedioic Acid; (2S)-2-[[4-[1-[(2-Amino-4-Keto-1H-Quinazolin-6-Yl)Methyl]-2-Keto-Ethyl]Benzoyl]Amino]Glutaric Acid
• Molecular Formula: C₂₃H₂₂N₄O₇
• Molecular Weight: 466.45
• CAS Registry Number: 143436-91-3
• SMILES: [C@H](NC(C3=CC=C(C(CC1=CC=C2C(=C1)C(N=C(N2)N)=O)C=O)C=C3)=O)(CCC(O)=O)C(O)=O
• InChI: 1S/C23H22N4O7/c24-23-26-17-6-1-12(10-16(17)21(32)27-23)9-15(11-28)13-2-4-14(5-3-13)20(31)25-18(22(33)34)7-8-19(29)30/h1-6,10-11,15,18H,7-9H2,(H,25,31)(H,29,30)(H,33,34)(H3,24,26,27,32)/t15?,18-/m0/s1
• InChIKey: QUTYGDYGQXUSRV-PKHIMPSTSA-N

Properties

• Density: 1.511g/cm³ (Cal.)