(7S,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol

C126H119N21O7 — CID 158585055

IUPAC(7S,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol
SMILESO[C@@H]1c2cccn2CC[C@@H]1[C@@H]1c2ccccc2-c2cncn21.O[C@@H]1c2cccn2CC[C@@H]1[C@H]1c2ccccc2-c2cncn21.O[C@@H]1c2cccn2CC[C@H]1[C@@H]1c2ccccc2-c2cncn21.O[C@@H]1c2cccn2CC[C@H]1[C@H]1c2ccccc2-c2cncn21.O[C@H]1c2cccn2CC[C@@H]1[C@@H]1c2ccccc2-c2cncn21.O[C@H]1c2cccn2CC[C@@H]1[C@H]1c2ccccc2-c2cncn21.O[C@H]1c2cccn2CC[C@H]1[C@H]1c2ccccc2-c2cncn21
InChIInChI=1S/7C18H17N3O/c7*22-18-14(7-9-20-8-3-6-15(18)20)17-13-5-2-1-4-12(13)16-10-19-11-21(16)17/h7*1-6,8,10-11,14,17-18,22H,7,9H2/t2*14-,17+,18+;2*14-,17+,18-;14-,17-,18+;2*14-,17-,18-/m1010110/s1
InChIKeyHTSLYJHWHWMVAM-NPKBOYRJSA-N
MW2039.48 g/mol
LogP21.06
Rot. Bonds7

About (7S,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol

(7S,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol (PubChem CID 158585055) has the molecular formula C126H119N21O7 and a molecular weight of 2039.48 g/mol. Its IUPAC name is (7S,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol.

Molecular Properties

Compound Name(7S,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol
PubChem CID158585055
Molecular FormulaC126H119N21O7
Molecular Weight2039.48 g/mol
Exact Mass2037.96
IUPAC Name(7S,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol
SMILESO[C@@H]1c2cccn2CC[C@@H]1[C@@H]1c2ccccc2-c2cncn21.O[C@@H]1c2cccn2CC[C@@H]1[C@H]1c2ccccc2-c2cncn21.O[C@@H]1c2cccn2CC[C@H]1[C@@H]1c2ccccc2-c2cncn21.O[C@@H]1c2cccn2CC[C@H]1[C@H]1c2ccccc2-c2cncn21.O[C@H]1c2cccn2CC[C@@H]1[C@@H]1c2ccccc2-c2cncn21.O[C@H]1c2cccn2CC[C@@H]1[C@H]1c2ccccc2-c2cncn21.O[C@H]1c2cccn2CC[C@H]1[C@H]1c2ccccc2-c2cncn21
InChIInChI=1S/7C18H17N3O/c7*22-18-14(7-9-20-8-3-6-15(18)20)17-13-5-2-1-4-12(13)16-10-19-11-21(16)17/h7*1-6,8,10-11,14,17-18,22H,7,9H2/t2*14-,17+,18+;2*14-,17+,18-;14-,17-,18+;2*14-,17-,18-/m1010110/s1
InChIKeyHTSLYJHWHWMVAM-NPKBOYRJSA-N
XLogP21.06
TPSA300.86 Ų
H-Bond Donors7
H-Bond Acceptors28
Rotatable Bonds7
Heavy Atoms154
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002039.48
LogP ≤ 521.06
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1028

Analyze (7S,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol with MolForge

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Related Compounds

Bis(1-cyclohexyl-2-(10-fluoro-4,6,11-triazatricyclo[6.4.0.02,6]dodeca-1(12),2,4,8,10-pentaen-7-yl)ethanol);tetrakis(1-(4,4-difluorocyclohexyl)-2-(4,6,9-triazatricyclo[6.4.0.02,6]dodeca-1(8),2,4,9,11-pentaen-7-yl)ethanol)
CID 157558543
4-[4-[1-hydroxy-2-(5H-imidazo[5,1-a]isoindol-5-yl)ethyl]phenyl]morpholin-3-one;2-(5H-imidazo[5,1-a]isoindol-5-yl)-1-(4-morpholin-4-yl-3-nitrophenyl)ethanol;2-(5H-imidazo[5,1-a]isoindol-5-yl)-1-[1-(2-nitrophenyl)piperidin-4-yl]ethanol;2-(5H-imidazo[5,1-a]isoindol-5-yl)-1-[1-[2-nitro-4-(trifluoromethyl)phenyl]piperidin-4-yl]ethanol;2-(5H-imidazo[5,1-a]isoindol-5-yl)-1-[1-[4-(trifluoromethyl)phenyl]piperidin-4-yl]ethanol
CID 157857560
Bis(2-(10-chloro-4,6,9-triazatricyclo[6.4.0.02,6]dodeca-1(8),2,4,9,11-pentaen-7-yl)-1-(4,4-difluorocyclohexyl)ethanol);7-(2-cyclohexylethyl)-4,6,9-triazatricyclo[6.4.0.02,6]dodeca-1(8),2,4,9,11-pentaene;7-[2-(4,4-difluorocyclohexyl)ethyl]-4,6,9-triazatricyclo[6.4.0.02,6]dodeca-1(8),2,4,9,11-pentaene;7-[2-(4,4-dimethylcyclohexyl)ethyl]-4,6,9-triazatricyclo[6.4.0.02,6]dodeca-1(8),2,4,9,11-pentaene
CID 158344850
5-(2-cyclohexyl-2,2-difluoroethyl)-6-fluoro-5H-imidazo[5,1-a]isoindole;5-(2-cyclohexyl-2,2-difluoroethyl)-5H-imidazo[5,1-a]isoindole;tetrakis(1-cyclohexyl-2-(4,6,9,11-tetrazatricyclo[6.4.0.02,6]dodeca-1(12),2,4,8,10-pentaen-7-yl)ethanol)
CID 159436966
Bis(1-(4,4-difluorocyclohexyl)-2-(10-fluoro-4,6,9-triazatricyclo[6.4.0.02,6]dodeca-1(8),2,4,9,11-pentaen-7-yl)ethanol);1-(4,4-dimethylcyclohexyl)-2-(10-fluoro-4,6,9-triazatricyclo[6.4.0.02,6]dodeca-1(8),2,4,9,11-pentaen-7-yl)ethanol;bis(4-[2-(10-fluoro-4,6,9-triazatricyclo[6.4.0.02,6]dodeca-1(8),2,4,9,11-pentaen-7-yl)-1-hydroxyethyl]cyclohexan-1-ol)
CID 159441985
1-(4,4-difluorocyclohexyl)-2-[10-(trifluoromethyl)-4,6,9-triazatricyclo[6.4.0.02,6]dodeca-1(8),2,4,9,11-pentaen-7-yl]ethanol;bis(4-[1,1-difluoro-2-(6-fluoro-5H-imidazo[5,1-a]isoindol-5-yl)ethyl]cyclohexan-1-ol);bis(4-[1,1-difluoro-2-(5H-imidazo[5,1-a]isoindol-5-yl)ethyl]cyclohexan-1-ol);1-[4-(hydroxymethyl)cyclohexyl]-2-(4,6,9-triazatricyclo[6.4.0.02,6]dodeca-1(8),2,4,9,11-pentaen-7-yl)ethanol
CID 159872921
trans-(1R,6R)-2,2-difluoro-6-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,6R)-2,2-difluoro-6-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1S,6S)-2,2-difluoro-6-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1S,6S)-2,2-difluoro-6-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol
CID 159874874
tris(1-(4,4-difluorocyclohexyl)-2-[10-(trifluoromethyl)-4,6,9-triazatricyclo[6.4.0.02,6]dodeca-1(8),2,4,9,11-pentaen-7-yl]ethanol);bis(4-[2-(6,9-difluoro-5H-imidazo[5,1-a]isoindol-5-yl)-1,1-difluoroethyl]cyclohexan-1-ol);1-[4-[1-hydroxy-2-(4,6,9-triazatricyclo[6.4.0.02,6]dodeca-1(8),2,4,9,11-pentaen-7-yl)ethyl]piperidin-1-yl]-2,2-dimethylpropan-1-one
CID 159996646
1-[4-fluoro-4-[2-(6-fluoro-5H-imidazo[5,1-a]isoindol-5-yl)ethyl]cyclohexyl]cyclopropan-1-ol;bis(2-[4-fluoro-4-[2-(6-fluoro-5H-imidazo[5,1-a]isoindol-5-yl)ethyl]cyclohexyl]propan-2-ol);tris(2-(4,6,9-triazatricyclo[6.4.0.02,6]dodeca-1(8),2,4,9,11-pentaen-7-yl)-1-(1,4,4-trifluorocyclohexyl)ethanol)
CID 160103268
cis-(1S,2S)-4,4-difluoro-2-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;cis-(1R,2R)-4,4-difluoro-2-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;cis-(1S,2S)-4,4-difluoro-2-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;cis-(1R,2R)-4,4-difluoro-2-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-4,4-difluoro-2-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-4,4-difluoro-2-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1S,2R)-4,4-difluoro-2-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1S,2R)-4,4-difluoro-2-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol
CID 160486186
4-(5H-imidazo[5,1-a]isoindol-5-yl)-1-methylpiperidin-3-ol;4-(5H-imidazo[5,1-a]isoindol-5-yl)-1-(2,2,2-trifluoroethyl)piperidin-3-ol
CID 160720058
1-Cyclohexyl-2-(10-cyclopropyl-4,6,9-triazatricyclo[6.4.0.02,6]dodeca-1(8),2,4,9,11-pentaen-7-yl)ethanol;bis(1-cyclohexyl-3-(4,6,9-triazatricyclo[6.4.0.02,6]dodeca-1(8),2,4,9,11-pentaen-7-yl)propan-2-ol);tris(2-(10-cyclopropyl-4,6,9-triazatricyclo[6.4.0.02,6]dodeca-1(8),2,4,9,11-pentaen-7-yl)-1-(4,4-difluorocyclohexyl)ethanol)
CID 160827395

Frequently Asked Questions

What is the IUPAC name of (7S,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol?
The IUPAC name of (7S,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol (CID 158585055) is (7S,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol.
What is the SMILES notation for (7S,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol?
The canonical SMILES for (7S,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol is O[C@@H]1c2cccn2CC[C@@H]1[C@@H]1c2ccccc2-c2cncn21.O[C@@H]1c2cccn2CC[C@@H]1[C@H]1c2ccccc2-c2cncn21.O[C@@H]1c2cccn2CC[C@H]1[C@@H]1c2ccccc2-c2cncn21.O[C@@H]1c2cccn2CC[C@H]1[C@H]1c2ccccc2-c2cncn21.O[C@H]1c2cccn2CC[C@@H]1[C@@H]1c2ccccc2-c2cncn21.O[C@H]1c2cccn2CC[C@@H]1[C@H]1c2ccccc2-c2cncn21.O[C@H]1c2cccn2CC[C@H]1[C@H]1c2ccccc2-c2cncn21.
What is the InChIKey of (7S,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol?
The InChIKey is HTSLYJHWHWMVAM-NPKBOYRJSA-N. The full InChI is InChI=1S/7C18H17N3O/c7*22-18-14(7-9-20-8-3-6-15(18)20)17-13-5-2-1-4-12(13)16-10-19-11-21(16)17/h7*1-6,8,10-11,14,17-18,22H,7,9H2/t2*14-,17+,18+;2*14-,17+,18-;14-,17-,18+;2*14-,17-,18-/m1010110/s1.
What are the key properties of (7S,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol?
(7S,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol has a molecular weight of 2039.48 g/mol, XLogP of 21.06, 7 rotatable bonds, 7 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for (7S,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7S,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8S)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol;(7R,8R)-7-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydroindolizin-8-ol is sourced from PubChem (CID 158585055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).