About 2-[[5-[2-chloro-3-[2-chloro-3-[(1R)-7-methoxy-1-(6-oxo-2,5-diazaspiro[3.4]octan-2-yl)-2,3-dihydro-1H-inden-5-yl]phenyl]phenyl]-3-methoxypyrazin-2-yl]methyl]-2,5-diazaspiro[3.4]octan-6-one
2-[[5-[2-chloro-3-[2-chloro-3-[(1R)-7-methoxy-1-(6-oxo-2,5-diazaspiro[3.4]octan-2-yl)-2,3-dihydro-1H-inden-5-yl]phenyl]phenyl]-3-methoxypyrazin-2-yl]methyl]-2,5-diazaspiro[3.4]octan-6-one (PubChem CID 167374345) has the molecular formula C40H40Cl2N6O4
and a molecular weight of 739.70 g/mol. Its IUPAC name is 2-[[5-[2-chloro-3-[2-chloro-3-[(1R)-7-methoxy-1-(6-oxo-2,5-diazaspiro[3.4]octan-2-yl)-2,3-dihydro-1H-inden-5-yl]phenyl]phenyl]-3-methoxypyrazin-2-yl]methyl]-2,5-diazaspiro[3.4]octan-6-one.
Analyze 2-[[5-[2-chloro-3-[2-chloro-3-[(1R)-7-methoxy-1-(6-oxo-2,5-diazaspiro[3.4]octan-2-yl)-2,3-dihydro-1H-inden-5-yl]phenyl]phenyl]-3-methoxypyrazin-2-yl]methyl]-2,5-diazaspiro[3.4]octan-6-one with MolForge
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Frequently Asked Questions
What is the IUPAC name of 2-[[5-[2-chloro-3-[2-chloro-3-[(1R)-7-methoxy-1-(6-oxo-2,5-diazaspiro[3.4]octan-2-yl)-2,3-dihydro-1H-inden-5-yl]phenyl]phenyl]-3-methoxypyrazin-2-yl]methyl]-2,5-diazaspiro[3.4]octan-6-one?
The IUPAC name of 2-[[5-[2-chloro-3-[2-chloro-3-[(1R)-7-methoxy-1-(6-oxo-2,5-diazaspiro[3.4]octan-2-yl)-2,3-dihydro-1H-inden-5-yl]phenyl]phenyl]-3-methoxypyrazin-2-yl]methyl]-2,5-diazaspiro[3.4]octan-6-one (CID 167374345) is 2-[[5-[2-chloro-3-[2-chloro-3-[(1R)-7-methoxy-1-(6-oxo-2,5-diazaspiro[3.4]octan-2-yl)-2,3-dihydro-1H-inden-5-yl]phenyl]phenyl]-3-methoxypyrazin-2-yl]methyl]-2,5-diazaspiro[3.4]octan-6-one.
What is the SMILES notation for 2-[[5-[2-chloro-3-[2-chloro-3-[(1R)-7-methoxy-1-(6-oxo-2,5-diazaspiro[3.4]octan-2-yl)-2,3-dihydro-1H-inden-5-yl]phenyl]phenyl]-3-methoxypyrazin-2-yl]methyl]-2,5-diazaspiro[3.4]octan-6-one?
The canonical SMILES for 2-[[5-[2-chloro-3-[2-chloro-3-[(1R)-7-methoxy-1-(6-oxo-2,5-diazaspiro[3.4]octan-2-yl)-2,3-dihydro-1H-inden-5-yl]phenyl]phenyl]-3-methoxypyrazin-2-yl]methyl]-2,5-diazaspiro[3.4]octan-6-one is COc1cc(-c2cccc(-c3cccc(-c4cnc(CN5CC6(CCC(=O)N6)C5)c(OC)n4)c3Cl)c2Cl)cc2c1[C@H](N1CC3(CCC(=O)N3)C1)CC2.
What is the InChIKey of 2-[[5-[2-chloro-3-[2-chloro-3-[(1R)-7-methoxy-1-(6-oxo-2,5-diazaspiro[3.4]octan-2-yl)-2,3-dihydro-1H-inden-5-yl]phenyl]phenyl]-3-methoxypyrazin-2-yl]methyl]-2,5-diazaspiro[3.4]octan-6-one?
The InChIKey is WLTRQJVPHKMSIF-WJOKGBTCSA-N. The full InChI is InChI=1S/C40H40Cl2N6O4/c1-51-32-16-24(15-23-9-10-31(35(23)32)48-21-40(22-48)14-12-34(50)46-40)25-5-3-6-26(36(25)41)27-7-4-8-28(37(27)42)29-17-43-30(38(44-29)52-2)18-47-19-39(20-47)13-11-33(49)45-39/h3-8,15-17,31H,9-14,18-22H2,1-2H3,(H,45,49)(H,46,50)/t31-/m1/s1.
What are the key properties of 2-[[5-[2-chloro-3-[2-chloro-3-[(1R)-7-methoxy-1-(6-oxo-2,5-diazaspiro[3.4]octan-2-yl)-2,3-dihydro-1H-inden-5-yl]phenyl]phenyl]-3-methoxypyrazin-2-yl]methyl]-2,5-diazaspiro[3.4]octan-6-one?
2-[[5-[2-chloro-3-[2-chloro-3-[(1R)-7-methoxy-1-(6-oxo-2,5-diazaspiro[3.4]octan-2-yl)-2,3-dihydro-1H-inden-5-yl]phenyl]phenyl]-3-methoxypyrazin-2-yl]methyl]-2,5-diazaspiro[3.4]octan-6-one has a molecular weight of 739.70 g/mol, XLogP of 6.22, 8 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[5-[2-chloro-3-[2-chloro-3-[(1R)-7-methoxy-1-(6-oxo-2,5-diazaspiro[3.4]octan-2-yl)-2,3-dihydro-1H-inden-5-yl]phenyl]phenyl]-3-methoxypyrazin-2-yl]methyl]-2,5-diazaspiro[3.4]octan-6-one is sourced from PubChem (CID 167374345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).