Carzelesin
[CAS# 119813-10-4]

Identification

• Name: Carzelesin
• Synonyms: [(8S)-8-(Chloromethyl)-6-[5-[(6-Diethylaminobenzofuran-2-Carbonyl)Amino]1H-Indole-2-Carbonyl]-1-Methyl-7,8-Dihydro-3H-Pyrrolo[3,2-E]Indol-4-Yl] N-Phenylcarbamate; N-Phenylcarbamic Acid [(8S)-8-(Chloromethyl)-6-[[5-[[(6-Diethylamino-2-Benzofuranyl)-Oxomethyl]Amino]-1H-Indol-2-Yl]-Oxomethyl]-1-Methyl-7,8-Dihydro-3H-Pyrrolo[3,2-E]Indol-4-Yl] Ester; N-Phenylcarbamic Acid [(8S)-8-(Chloromethyl)-6-[5-[(6-Diethylaminobenzofuran-2-Carbonyl)Amino]1H-Indole-2-Carbonyl]-1-Methyl-7,8-Dihydro-3H-Pyrrolo[3,2-E]Indol-4-Yl] Ester
• Molecular Formula: C₄₁H₃₇ClN₆O₅
• Molecular Weight: 729.23
• CAS Registry Number: 119813-10-4
• SMILES: [C@@H]5(C7=C(N(C(C1=CC2=C([NH]1)C=CC(=C2)NC(C3=CC4=C(O3)C=C(N(CC)CC)C=C4)=O)=O)C5)C=C(OC(NC6=CC=CC=C6)=O)C8=C7C(=C[NH]8)C)CCl
• InChI: 1S/C41H37ClN6O5/c1-4-47(5-2)29-13-11-24-17-35(52-33(24)18-29)39(49)44-28-12-14-30-25(15-28)16-31(46-30)40(50)48-22-26(20-42)37-32(48)19-34(38-36(37)23(3)21-43-38)53-41(51)45-27-9-7-6-8-10-27/h6-19,21,26,43,46H,4-5,20,22H2,1-3H3,(H,44,49)(H,45,51)/t26-/m1/s1
• InChIKey: BBZDXMBRAFTCAA-AREMUKBSSA-N

Properties

• Density: 1.424g/cm³ (Cal.)
• Boiling point: 866.843°C at 760 mmHg (Cal.)
• Flash point: 478.049°C (Cal.)