2-[2-(2-chlorophenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;2-[2-(3-chloro-2-pyridinyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[2-(2-methylphenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide

C169H156Cl2F9N33O26 — CID 158394919

IUPAC2-[2-(2-chlorophenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;2-[2-(3-chloro-2-pyridinyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[2-(2-methylphenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide
SMILESCN1C(=O)NC(=O)[C@@]12Cc1ccc(NC(=O)CN3C(=O)C4(CCCC4)N=C3c3ccccc3C(F)(F)F)cc1C2.CN1C(=O)NC(=O)[C@@]12Cc1ccc(NC(=O)CN3C(=O)C4(CCOCC4)N=C3c3ccccc3Cl)cc1C2.CN1C(=O)NC(=O)[C@@]12Cc1ccc(NC(=O)CN3C(=O)C4(CCOCC4)N=C3c3ncccc3Cl)cc1C2.Cc1ccccc1C1=NC2(CCOCC2)C(=O)N1CC(=O)Nc1ccc2c(c1)C[C@@]1(C2)C(=O)NC(=O)N1C.O=C(CN1C(=O)C2(CCCC2)N=C1c1ccccc1C(F)(F)F)Nc1cc2c(cn1)C[C@]1(C2)C(=O)Nc2ncccc21.O=C(CN1C(=O)C2(CCOCC2)N=C1c1ccccc1C(F)(F)F)Nc1cc2c(cn1)C[C@]1(C2)C(=O)Nc2ncccc21
InChIInChI=1S/C30H25F3N6O4.C30H25F3N6O3.C28H26F3N5O4.C28H29N5O5.C27H26ClN5O5.C26H25ClN6O5/c31-30(32,33)20-5-2-1-4-19(20)25-38-29(7-10-43-11-8-29)27(42)39(25)16-23(40)36-22-12-17-13-28(14-18(17)15-35-22)21-6-3-9-34-24(21)37-26(28)41;31-30(32,33)20-7-2-1-6-19(20)25-38-29(9-3-4-10-29)27(42)39(25)16-23(40)36-22-12-17-13-28(14-18(17)15-35-22)21-8-5-11-34-24(21)37-26(28)41;1-35-25(40)33-23(38)27(35)13-16-8-9-18(12-17(16)14-27)32-21(37)15-36-22(34-26(24(36)39)10-4-5-11-26)19-6-2-3-7-20(19)28(29,30)31;1-17-5-3-4-6-21(17)23-31-27(9-11-38-12-10-27)25(36)33(23)16-22(34)29-20-8-7-18-14-28(15-19(18)13-20)24(35)30-26(37)32(28)2;1-32-25(37)30-23(35)27(32)13-16-6-7-18(12-17(16)14-27)29-21(34)15-33-22(19-4-2-3-5-20(19)28)31-26(24(33)36)8-10-38-11-9-26;1-32-24(37)30-22(35)26(32)12-15-4-5-17(11-16(15)13-26)29-19(34)14-33-21(20-18(27)3-2-8-28-20)31-25(23(33)36)6-9-38-10-7-25/h1-6,9,12,15H,7-8,10-11,13-14,16H2,(H,34,37,41)(H,35,36,40);1-2,5-8,11-12,15H,3-4,9-10,13-14,16H2,(H,34,37,41)(H,35,36,40);2-3,6-9,12H,4-5,10-11,13-15H2,1H3,(H,32,37)(H,33,38,40);3-8,13H,9-12,14-16H2,1-2H3,(H,29,34)(H,30,35,37);2-7,12H,8-11,13-15H2,1H3,(H,29,34)(H,30,35,37);2-5,8,11H,6-7,9-10,12-14H2,1H3,(H,29,34)(H,30,35,37)/t2*28-;27-;28-;27-;26-/m000000/s1
InChIKeyGXKTYJHVPFCEFR-LCOVVVKYSA-N
MW3307.20 g/mol
LogP16.01
Rot. Bonds24

About 2-[2-(2-chlorophenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;2-[2-(3-chloro-2-pyridinyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[2-(2-methylphenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide

2-[2-(2-chlorophenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;2-[2-(3-chloro-2-pyridinyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[2-(2-methylphenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide (PubChem CID 158394919) has the molecular formula C169H156Cl2F9N33O26 and a molecular weight of 3307.20 g/mol. Its IUPAC name is 2-[2-(2-chlorophenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;2-[2-(3-chloro-2-pyridinyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[2-(2-methylphenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide.

Molecular Properties

Compound Name2-[2-(2-chlorophenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;2-[2-(3-chloro-2-pyridinyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[2-(2-methylphenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide
PubChem CID158394919
Molecular FormulaC169H156Cl2F9N33O26
Molecular Weight3307.20 g/mol
Exact Mass3304.11
IUPAC Name2-[2-(2-chlorophenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;2-[2-(3-chloro-2-pyridinyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[2-(2-methylphenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide
SMILESCN1C(=O)NC(=O)[C@@]12Cc1ccc(NC(=O)CN3C(=O)C4(CCCC4)N=C3c3ccccc3C(F)(F)F)cc1C2.CN1C(=O)NC(=O)[C@@]12Cc1ccc(NC(=O)CN3C(=O)C4(CCOCC4)N=C3c3ccccc3Cl)cc1C2.CN1C(=O)NC(=O)[C@@]12Cc1ccc(NC(=O)CN3C(=O)C4(CCOCC4)N=C3c3ncccc3Cl)cc1C2.Cc1ccccc1C1=NC2(CCOCC2)C(=O)N1CC(=O)Nc1ccc2c(c1)C[C@@]1(C2)C(=O)NC(=O)N1C.O=C(CN1C(=O)C2(CCCC2)N=C1c1ccccc1C(F)(F)F)Nc1cc2c(cn1)C[C@]1(C2)C(=O)Nc2ncccc21.O=C(CN1C(=O)C2(CCOCC2)N=C1c1ccccc1C(F)(F)F)Nc1cc2c(cn1)C[C@]1(C2)C(=O)Nc2ncccc21
InChIInChI=1S/C30H25F3N6O4.C30H25F3N6O3.C28H26F3N5O4.C28H29N5O5.C27H26ClN5O5.C26H25ClN6O5/c31-30(32,33)20-5-2-1-4-19(20)25-38-29(7-10-43-11-8-29)27(42)39(25)16-23(40)36-22-12-17-13-28(14-18(17)15-35-22)21-6-3-9-34-24(21)37-26(28)41;31-30(32,33)20-7-2-1-6-19(20)25-38-29(9-3-4-10-29)27(42)39(25)16-23(40)36-22-12-17-13-28(14-18(17)15-35-22)21-8-5-11-34-24(21)37-26(28)41;1-35-25(40)33-23(38)27(35)13-16-8-9-18(12-17(16)14-27)32-21(37)15-36-22(34-26(24(36)39)10-4-5-11-26)19-6-2-3-7-20(19)28(29,30)31;1-17-5-3-4-6-21(17)23-31-27(9-11-38-12-10-27)25(36)33(23)16-22(34)29-20-8-7-18-14-28(15-19(18)13-20)24(35)30-26(37)32(28)2;1-32-25(37)30-23(35)27(32)13-16-6-7-18(12-17(16)14-27)29-21(34)15-33-22(19-4-2-3-5-20(19)28)31-26(24(33)36)8-10-38-11-9-26;1-32-24(37)30-22(35)26(32)12-15-4-5-17(11-16(15)13-26)29-19(34)14-33-21(20-18(27)3-2-8-28-20)31-25(23(33)36)6-9-38-10-7-25/h1-6,9,12,15H,7-8,10-11,13-14,16H2,(H,34,37,41)(H,35,36,40);1-2,5-8,11-12,15H,3-4,9-10,13-14,16H2,(H,34,37,41)(H,35,36,40);2-3,6-9,12H,4-5,10-11,13-15H2,1H3,(H,32,37)(H,33,38,40);3-8,13H,9-12,14-16H2,1-2H3,(H,29,34)(H,30,35,37);2-7,12H,8-11,13-15H2,1H3,(H,29,34)(H,30,35,37);2-5,8,11H,6-7,9-10,12-14H2,1H3,(H,29,34)(H,30,35,37)/t2*28-;27-;28-;27-;26-/m000000/s1
InChIKeyGXKTYJHVPFCEFR-LCOVVVKYSA-N
XLogP16.01
TPSA727.83 Ų
H-Bond Donors12
H-Bond Acceptors37
Rotatable Bonds24
Heavy Atoms239
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003307.20
LogP ≤ 516.01
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1037

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

Analyze 2-[2-(2-chlorophenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;2-[2-(3-chloro-2-pyridinyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[2-(2-methylphenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-chlorophenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;2-[2-(3-chloro-2-pyridinyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[2-(2-methylphenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide?
The IUPAC name of 2-[2-(2-chlorophenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;2-[2-(3-chloro-2-pyridinyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[2-(2-methylphenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide (CID 158394919) is 2-[2-(2-chlorophenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;2-[2-(3-chloro-2-pyridinyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[2-(2-methylphenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide.
What is the SMILES notation for 2-[2-(2-chlorophenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;2-[2-(3-chloro-2-pyridinyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[2-(2-methylphenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide?
The canonical SMILES for 2-[2-(2-chlorophenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;2-[2-(3-chloro-2-pyridinyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[2-(2-methylphenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide is CN1C(=O)NC(=O)[C@@]12Cc1ccc(NC(=O)CN3C(=O)C4(CCCC4)N=C3c3ccccc3C(F)(F)F)cc1C2.CN1C(=O)NC(=O)[C@@]12Cc1ccc(NC(=O)CN3C(=O)C4(CCOCC4)N=C3c3ccccc3Cl)cc1C2.CN1C(=O)NC(=O)[C@@]12Cc1ccc(NC(=O)CN3C(=O)C4(CCOCC4)N=C3c3ncccc3Cl)cc1C2.Cc1ccccc1C1=NC2(CCOCC2)C(=O)N1CC(=O)Nc1ccc2c(c1)C[C@@]1(C2)C(=O)NC(=O)N1C.O=C(CN1C(=O)C2(CCCC2)N=C1c1ccccc1C(F)(F)F)Nc1cc2c(cn1)C[C@]1(C2)C(=O)Nc2ncccc21.O=C(CN1C(=O)C2(CCOCC2)N=C1c1ccccc1C(F)(F)F)Nc1cc2c(cn1)C[C@]1(C2)C(=O)Nc2ncccc21.
What is the InChIKey of 2-[2-(2-chlorophenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;2-[2-(3-chloro-2-pyridinyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[2-(2-methylphenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide?
The InChIKey is GXKTYJHVPFCEFR-LCOVVVKYSA-N. The full InChI is InChI=1S/C30H25F3N6O4.C30H25F3N6O3.C28H26F3N5O4.C28H29N5O5.C27H26ClN5O5.C26H25ClN6O5/c31-30(32,33)20-5-2-1-4-19(20)25-38-29(7-10-43-11-8-29)27(42)39(25)16-23(40)36-22-12-17-13-28(14-18(17)15-35-22)21-6-3-9-34-24(21)37-26(28)41;31-30(32,33)20-7-2-1-6-19(20)25-38-29(9-3-4-10-29)27(42)39(25)16-23(40)36-22-12-17-13-28(14-18(17)15-35-22)21-8-5-11-34-24(21)37-26(28)41;1-35-25(40)33-23(38)27(35)13-16-8-9-18(12-17(16)14-27)32-21(37)15-36-22(34-26(24(36)39)10-4-5-11-26)19-6-2-3-7-20(19)28(29,30)31;1-17-5-3-4-6-21(17)23-31-27(9-11-38-12-10-27)25(36)33(23)16-22(34)29-20-8-7-18-14-28(15-19(18)13-20)24(35)30-26(37)32(28)2;1-32-25(37)30-23(35)27(32)13-16-6-7-18(12-17(16)14-27)29-21(34)15-33-22(19-4-2-3-5-20(19)28)31-26(24(33)36)8-10-38-11-9-26;1-32-24(37)30-22(35)26(32)12-15-4-5-17(11-16(15)13-26)29-19(34)14-33-21(20-18(27)3-2-8-28-20)31-25(23(33)36)6-9-38-10-7-25/h1-6,9,12,15H,7-8,10-11,13-14,16H2,(H,34,37,41)(H,35,36,40);1-2,5-8,11-12,15H,3-4,9-10,13-14,16H2,(H,34,37,41)(H,35,36,40);2-3,6-9,12H,4-5,10-11,13-15H2,1H3,(H,32,37)(H,33,38,40);3-8,13H,9-12,14-16H2,1-2H3,(H,29,34)(H,30,35,37);2-7,12H,8-11,13-15H2,1H3,(H,29,34)(H,30,35,37);2-5,8,11H,6-7,9-10,12-14H2,1H3,(H,29,34)(H,30,35,37)/t2*28-;27-;28-;27-;26-/m000000/s1.
What are the key properties of 2-[2-(2-chlorophenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;2-[2-(3-chloro-2-pyridinyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[2-(2-methylphenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide?
2-[2-(2-chlorophenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;2-[2-(3-chloro-2-pyridinyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[2-(2-methylphenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide has a molecular weight of 3307.20 g/mol, XLogP of 16.01, 24 rotatable bonds, 12 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-chlorophenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;2-[2-(3-chloro-2-pyridinyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]-N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[2-(2-methylphenyl)-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide;N-[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.4]non-1-en-3-yl]acetamide;N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[c]pyridine]-3'-yl]-2-[4-oxo-2-[2-(trifluoromethyl)phenyl]-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl]acetamide is sourced from PubChem (CID 158394919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).