benzyl 8-(3,5-difluorophenyl)-10-oxo-9-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-1,9-diazaspiro[4.5]decane-1-carboxylate;benzyl 3-(3,5-difluorophenyl)-1-oxo-2-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-2,9-diazaspiro[5.5]undecane-9-carboxylate;2-[8-(3,5-difluorophenyl)-1-methyl-10-oxo-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide;2-[8-(3,5-difluorophenyl)-10-oxo-1-(2,2,2-trifluoroethyl)-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide

C144H133F11N20O16 — CID 158005848

IUPACbenzyl 8-(3,5-difluorophenyl)-10-oxo-9-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-1,9-diazaspiro[4.5]decane-1-carboxylate;benzyl 3-(3,5-difluorophenyl)-1-oxo-2-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-2,9-diazaspiro[5.5]undecane-9-carboxylate;2-[8-(3,5-difluorophenyl)-1-methyl-10-oxo-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide;2-[8-(3,5-difluorophenyl)-10-oxo-1-(2,2,2-trifluoroethyl)-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide
SMILESCN1CCCC12CCC(c1cc(F)cc(F)c1)N(CC(=O)Nc1ccc3c(c1)CC1(C3)C(=O)Nc3ncccc31)C2=O.O=C(CN1C(=O)C2(CCC1c1cc(F)cc(F)c1)CCN(C(=O)OCc1ccccc1)CC2)Nc1ccc2c(c1)CC1(C2)C(=O)Nc2ncccc21.O=C(CN1C(=O)C2(CCCN2C(=O)OCc2ccccc2)CCC1c1cc(F)cc(F)c1)Nc1ccc2c(c1)CC1(C2)C(=O)Nc2ncccc21.O=C(CN1C(=O)C2(CCCN2CC(F)(F)F)CCC1c1cc(F)cc(F)c1)Nc1ccc2c(c1)CC1(C2)C(=O)Nc2ncccc21
InChIInChI=1S/C40H37F2N5O5.C39H35F2N5O5.C33H30F5N5O3.C32H31F2N5O3/c41-29-17-27(18-30(42)20-29)33-10-11-39(12-15-46(16-13-39)38(51)52-24-25-5-2-1-3-6-25)37(50)47(33)23-34(48)44-31-9-8-26-21-40(22-28(26)19-31)32-7-4-14-43-35(32)45-36(40)49;40-28-16-26(17-29(41)19-28)32-11-13-39(12-5-15-46(39)37(50)51-23-24-6-2-1-3-7-24)36(49)45(32)22-33(47)43-30-10-9-25-20-38(21-27(25)18-30)31-8-4-14-42-34(31)44-35(38)48;34-22-11-20(12-23(35)14-22)26-6-8-32(7-2-10-42(32)18-33(36,37)38)30(46)43(26)17-27(44)40-24-5-4-19-15-31(16-21(19)13-24)25-3-1-9-39-28(25)41-29(31)45;1-38-11-3-8-32(38)9-7-26(20-12-22(33)15-23(34)13-20)39(30(32)42)18-27(40)36-24-6-5-19-16-31(17-21(19)14-24)25-4-2-10-35-28(25)37-29(31)41/h1-9,14,17-20,33H,10-13,15-16,21-24H2,(H,44,48)(H,43,45,49);1-4,6-10,14,16-19,32H,5,11-13,15,20-23H2,(H,43,47)(H,42,44,48);1,3-5,9,11-14,26H,2,6-8,10,15-18H2,(H,40,44)(H,39,41,45);2,4-6,10,12-15,26H,3,7-9,11,16-18H2,1H3,(H,36,40)(H,35,37,41)
InChIKeyFEGZEIUKXXSJHT-UHFFFAOYSA-N
MW2608.75 g/mol
LogP21.05
Rot. Bonds21

About benzyl 8-(3,5-difluorophenyl)-10-oxo-9-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-1,9-diazaspiro[4.5]decane-1-carboxylate;benzyl 3-(3,5-difluorophenyl)-1-oxo-2-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-2,9-diazaspiro[5.5]undecane-9-carboxylate;2-[8-(3,5-difluorophenyl)-1-methyl-10-oxo-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide;2-[8-(3,5-difluorophenyl)-10-oxo-1-(2,2,2-trifluoroethyl)-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide

benzyl 8-(3,5-difluorophenyl)-10-oxo-9-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-1,9-diazaspiro[4.5]decane-1-carboxylate;benzyl 3-(3,5-difluorophenyl)-1-oxo-2-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-2,9-diazaspiro[5.5]undecane-9-carboxylate;2-[8-(3,5-difluorophenyl)-1-methyl-10-oxo-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide;2-[8-(3,5-difluorophenyl)-10-oxo-1-(2,2,2-trifluoroethyl)-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide (PubChem CID 158005848) has the molecular formula C144H133F11N20O16 and a molecular weight of 2608.75 g/mol. Its IUPAC name is benzyl 8-(3,5-difluorophenyl)-10-oxo-9-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-1,9-diazaspiro[4.5]decane-1-carboxylate;benzyl 3-(3,5-difluorophenyl)-1-oxo-2-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-2,9-diazaspiro[5.5]undecane-9-carboxylate;2-[8-(3,5-difluorophenyl)-1-methyl-10-oxo-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide;2-[8-(3,5-difluorophenyl)-10-oxo-1-(2,2,2-trifluoroethyl)-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide.

Molecular Properties

Compound Namebenzyl 8-(3,5-difluorophenyl)-10-oxo-9-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-1,9-diazaspiro[4.5]decane-1-carboxylate;benzyl 3-(3,5-difluorophenyl)-1-oxo-2-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-2,9-diazaspiro[5.5]undecane-9-carboxylate;2-[8-(3,5-difluorophenyl)-1-methyl-10-oxo-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide;2-[8-(3,5-difluorophenyl)-10-oxo-1-(2,2,2-trifluoroethyl)-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide
PubChem CID158005848
Molecular FormulaC144H133F11N20O16
Molecular Weight2608.75 g/mol
Exact Mass2607.00
IUPAC Namebenzyl 8-(3,5-difluorophenyl)-10-oxo-9-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-1,9-diazaspiro[4.5]decane-1-carboxylate;benzyl 3-(3,5-difluorophenyl)-1-oxo-2-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-2,9-diazaspiro[5.5]undecane-9-carboxylate;2-[8-(3,5-difluorophenyl)-1-methyl-10-oxo-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide;2-[8-(3,5-difluorophenyl)-10-oxo-1-(2,2,2-trifluoroethyl)-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide
SMILESCN1CCCC12CCC(c1cc(F)cc(F)c1)N(CC(=O)Nc1ccc3c(c1)CC1(C3)C(=O)Nc3ncccc31)C2=O.O=C(CN1C(=O)C2(CCC1c1cc(F)cc(F)c1)CCN(C(=O)OCc1ccccc1)CC2)Nc1ccc2c(c1)CC1(C2)C(=O)Nc2ncccc21.O=C(CN1C(=O)C2(CCCN2C(=O)OCc2ccccc2)CCC1c1cc(F)cc(F)c1)Nc1ccc2c(c1)CC1(C2)C(=O)Nc2ncccc21.O=C(CN1C(=O)C2(CCCN2CC(F)(F)F)CCC1c1cc(F)cc(F)c1)Nc1ccc2c(c1)CC1(C2)C(=O)Nc2ncccc21
InChIInChI=1S/C40H37F2N5O5.C39H35F2N5O5.C33H30F5N5O3.C32H31F2N5O3/c41-29-17-27(18-30(42)20-29)33-10-11-39(12-15-46(16-13-39)38(51)52-24-25-5-2-1-3-6-25)37(50)47(33)23-34(48)44-31-9-8-26-21-40(22-28(26)19-31)32-7-4-14-43-35(32)45-36(40)49;40-28-16-26(17-29(41)19-28)32-11-13-39(12-5-15-46(39)37(50)51-23-24-6-2-1-3-7-24)36(49)45(32)22-33(47)43-30-10-9-25-20-38(21-27(25)18-30)31-8-4-14-42-34(31)44-35(38)48;34-22-11-20(12-23(35)14-22)26-6-8-32(7-2-10-42(32)18-33(36,37)38)30(46)43(26)17-27(44)40-24-5-4-19-15-31(16-21(19)13-24)25-3-1-9-39-28(25)41-29(31)45;1-38-11-3-8-32(38)9-7-26(20-12-22(33)15-23(34)13-20)39(30(32)42)18-27(40)36-24-6-5-19-16-31(17-21(19)14-24)25-4-2-10-35-28(25)37-29(31)41/h1-9,14,17-20,33H,10-13,15-16,21-24H2,(H,44,48)(H,43,45,49);1-4,6-10,14,16-19,32H,5,11-13,15,20-23H2,(H,43,47)(H,42,44,48);1,3-5,9,11-14,26H,2,6-8,10,15-18H2,(H,40,44)(H,39,41,45);2,4-6,10,12-15,26H,3,7-9,11,16-18H2,1H3,(H,36,40)(H,35,37,41)
InChIKeyFEGZEIUKXXSJHT-UHFFFAOYSA-N
XLogP21.05
TPSA431.16 Ų
H-Bond Donors8
H-Bond Acceptors22
Rotatable Bonds21
Heavy Atoms191
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002608.75
LogP ≤ 521.05
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1022

Analyze benzyl 8-(3,5-difluorophenyl)-10-oxo-9-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-1,9-diazaspiro[4.5]decane-1-carboxylate;benzyl 3-(3,5-difluorophenyl)-1-oxo-2-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-2,9-diazaspiro[5.5]undecane-9-carboxylate;2-[8-(3,5-difluorophenyl)-1-methyl-10-oxo-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide;2-[8-(3,5-difluorophenyl)-10-oxo-1-(2,2,2-trifluoroethyl)-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of benzyl 8-(3,5-difluorophenyl)-10-oxo-9-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-1,9-diazaspiro[4.5]decane-1-carboxylate;benzyl 3-(3,5-difluorophenyl)-1-oxo-2-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-2,9-diazaspiro[5.5]undecane-9-carboxylate;2-[8-(3,5-difluorophenyl)-1-methyl-10-oxo-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide;2-[8-(3,5-difluorophenyl)-10-oxo-1-(2,2,2-trifluoroethyl)-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide?
The IUPAC name of benzyl 8-(3,5-difluorophenyl)-10-oxo-9-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-1,9-diazaspiro[4.5]decane-1-carboxylate;benzyl 3-(3,5-difluorophenyl)-1-oxo-2-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-2,9-diazaspiro[5.5]undecane-9-carboxylate;2-[8-(3,5-difluorophenyl)-1-methyl-10-oxo-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide;2-[8-(3,5-difluorophenyl)-10-oxo-1-(2,2,2-trifluoroethyl)-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide (CID 158005848) is benzyl 8-(3,5-difluorophenyl)-10-oxo-9-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-1,9-diazaspiro[4.5]decane-1-carboxylate;benzyl 3-(3,5-difluorophenyl)-1-oxo-2-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-2,9-diazaspiro[5.5]undecane-9-carboxylate;2-[8-(3,5-difluorophenyl)-1-methyl-10-oxo-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide;2-[8-(3,5-difluorophenyl)-10-oxo-1-(2,2,2-trifluoroethyl)-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide.
What is the SMILES notation for benzyl 8-(3,5-difluorophenyl)-10-oxo-9-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-1,9-diazaspiro[4.5]decane-1-carboxylate;benzyl 3-(3,5-difluorophenyl)-1-oxo-2-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-2,9-diazaspiro[5.5]undecane-9-carboxylate;2-[8-(3,5-difluorophenyl)-1-methyl-10-oxo-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide;2-[8-(3,5-difluorophenyl)-10-oxo-1-(2,2,2-trifluoroethyl)-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide?
The canonical SMILES for benzyl 8-(3,5-difluorophenyl)-10-oxo-9-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-1,9-diazaspiro[4.5]decane-1-carboxylate;benzyl 3-(3,5-difluorophenyl)-1-oxo-2-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-2,9-diazaspiro[5.5]undecane-9-carboxylate;2-[8-(3,5-difluorophenyl)-1-methyl-10-oxo-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide;2-[8-(3,5-difluorophenyl)-10-oxo-1-(2,2,2-trifluoroethyl)-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide is CN1CCCC12CCC(c1cc(F)cc(F)c1)N(CC(=O)Nc1ccc3c(c1)CC1(C3)C(=O)Nc3ncccc31)C2=O.O=C(CN1C(=O)C2(CCC1c1cc(F)cc(F)c1)CCN(C(=O)OCc1ccccc1)CC2)Nc1ccc2c(c1)CC1(C2)C(=O)Nc2ncccc21.O=C(CN1C(=O)C2(CCCN2C(=O)OCc2ccccc2)CCC1c1cc(F)cc(F)c1)Nc1ccc2c(c1)CC1(C2)C(=O)Nc2ncccc21.O=C(CN1C(=O)C2(CCCN2CC(F)(F)F)CCC1c1cc(F)cc(F)c1)Nc1ccc2c(c1)CC1(C2)C(=O)Nc2ncccc21.
What is the InChIKey of benzyl 8-(3,5-difluorophenyl)-10-oxo-9-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-1,9-diazaspiro[4.5]decane-1-carboxylate;benzyl 3-(3,5-difluorophenyl)-1-oxo-2-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-2,9-diazaspiro[5.5]undecane-9-carboxylate;2-[8-(3,5-difluorophenyl)-1-methyl-10-oxo-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide;2-[8-(3,5-difluorophenyl)-10-oxo-1-(2,2,2-trifluoroethyl)-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide?
The InChIKey is FEGZEIUKXXSJHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H37F2N5O5.C39H35F2N5O5.C33H30F5N5O3.C32H31F2N5O3/c41-29-17-27(18-30(42)20-29)33-10-11-39(12-15-46(16-13-39)38(51)52-24-25-5-2-1-3-6-25)37(50)47(33)23-34(48)44-31-9-8-26-21-40(22-28(26)19-31)32-7-4-14-43-35(32)45-36(40)49;40-28-16-26(17-29(41)19-28)32-11-13-39(12-5-15-46(39)37(50)51-23-24-6-2-1-3-7-24)36(49)45(32)22-33(47)43-30-10-9-25-20-38(21-27(25)18-30)31-8-4-14-42-34(31)44-35(38)48;34-22-11-20(12-23(35)14-22)26-6-8-32(7-2-10-42(32)18-33(36,37)38)30(46)43(26)17-27(44)40-24-5-4-19-15-31(16-21(19)13-24)25-3-1-9-39-28(25)41-29(31)45;1-38-11-3-8-32(38)9-7-26(20-12-22(33)15-23(34)13-20)39(30(32)42)18-27(40)36-24-6-5-19-16-31(17-21(19)14-24)25-4-2-10-35-28(25)37-29(31)41/h1-9,14,17-20,33H,10-13,15-16,21-24H2,(H,44,48)(H,43,45,49);1-4,6-10,14,16-19,32H,5,11-13,15,20-23H2,(H,43,47)(H,42,44,48);1,3-5,9,11-14,26H,2,6-8,10,15-18H2,(H,40,44)(H,39,41,45);2,4-6,10,12-15,26H,3,7-9,11,16-18H2,1H3,(H,36,40)(H,35,37,41).
What are the key properties of benzyl 8-(3,5-difluorophenyl)-10-oxo-9-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-1,9-diazaspiro[4.5]decane-1-carboxylate;benzyl 3-(3,5-difluorophenyl)-1-oxo-2-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-2,9-diazaspiro[5.5]undecane-9-carboxylate;2-[8-(3,5-difluorophenyl)-1-methyl-10-oxo-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide;2-[8-(3,5-difluorophenyl)-10-oxo-1-(2,2,2-trifluoroethyl)-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide?
benzyl 8-(3,5-difluorophenyl)-10-oxo-9-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-1,9-diazaspiro[4.5]decane-1-carboxylate;benzyl 3-(3,5-difluorophenyl)-1-oxo-2-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-2,9-diazaspiro[5.5]undecane-9-carboxylate;2-[8-(3,5-difluorophenyl)-1-methyl-10-oxo-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide;2-[8-(3,5-difluorophenyl)-10-oxo-1-(2,2,2-trifluoroethyl)-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide has a molecular weight of 2608.75 g/mol, XLogP of 21.05, 21 rotatable bonds, 8 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl 8-(3,5-difluorophenyl)-10-oxo-9-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-1,9-diazaspiro[4.5]decane-1-carboxylate;benzyl 3-(3,5-difluorophenyl)-1-oxo-2-[2-oxo-2-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]ethyl]-2,9-diazaspiro[5.5]undecane-9-carboxylate;2-[8-(3,5-difluorophenyl)-1-methyl-10-oxo-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide;2-[8-(3,5-difluorophenyl)-10-oxo-1-(2,2,2-trifluoroethyl)-1,9-diazaspiro[4.5]decan-9-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide is sourced from PubChem (CID 158005848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).