3,5-diamino-N-[8-[4-(1,3-benzothiazol-2-yl)butanoyl]-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[4-(dimethylamino)-7H-pyrrolo[3,2-d]pyrimidin-6-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[5-(dimethylsulfamoyl)-2,3-dihydroindol-1-yl]-4-oxobutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-1,3-dihydroindol-3-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-3-pyridin-3-ylbenzimidazol-1-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[2-oxo-3-(pyridin-3-ylmethyl)-3H-indol-1-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide

C156H182Cl6N60O18S2 — CID 158186854

IUPAC3,5-diamino-N-[8-[4-(1,3-benzothiazol-2-yl)butanoyl]-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[4-(dimethylamino)-7H-pyrrolo[3,2-d]pyrimidin-6-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[5-(dimethylsulfamoyl)-2,3-dihydroindol-1-yl]-4-oxobutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-1,3-dihydroindol-3-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-3-pyridin-3-ylbenzimidazol-1-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[2-oxo-3-(pyridin-3-ylmethyl)-3H-indol-1-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide
SMILESCN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)CCC(=O)N1CCC2(CC1)CN=C(NC(=O)c1nc(Cl)c(N)nc1N)N2.CN(C)c1ncnc2c1N=C(CCCC(=O)N1CCC3(CC1)CN=C(NC(=O)c1nc(Cl)c(N)nc1N)N3)C2.Nc1nc(N)c(C(=O)NC2=NC3(CC2)CCN(C(=O)CCCc2nc4ccccc4s2)CC3)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)CCCC4C(=O)Nc5ccccc54)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)CCCN4C(=O)C(Cc5cccnc5)c5ccccc54)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)CCCn4c(=O)n(-c5cccnc5)c5ccccc54)CC3)N2)nc1Cl
InChIInChI=1S/C30H33ClN10O3.C28H30ClN11O3.C26H33ClN10O5S.C24H31ClN12O2.C24H28ClN9O3.C24H27ClN8O2S/c31-24-26(33)37-25(32)23(36-24)27(43)38-29-35-17-30(39-29)9-13-40(14-10-30)22(42)8-4-12-41-21-7-2-1-6-19(21)20(28(41)44)15-18-5-3-11-34-16-18;29-22-24(31)35-23(30)21(34-22)25(42)36-26-33-16-28(37-26)9-13-38(14-10-28)20(41)8-4-12-39-18-6-1-2-7-19(18)40(27(39)43)17-5-3-11-32-15-17;1-35(2)43(41,42)16-3-4-17-15(13-16)7-10-37(17)19(39)6-5-18(38)36-11-8-26(9-12-36)14-30-25(34-26)33-24(40)20-22(28)32-23(29)21(27)31-20;1-36(2)21-16-14(29-12-30-21)10-13(31-16)4-3-5-15(38)37-8-6-24(7-9-37)11-28-23(35-24)34-22(39)17-19(26)33-20(27)18(25)32-17;25-18-20(27)31-19(26)17(30-18)22(37)32-23-28-12-24(33-23)8-10-34(11-9-24)16(35)7-3-5-14-13-4-1-2-6-15(13)29-21(14)36;25-20-22(27)31-21(26)19(30-20)23(35)29-16-8-9-24(32-16)10-12-33(13-11-24)18(34)7-3-6-17-28-14-4-1-2-5-15(14)36-17/h1-3,5-7,11,16,20H,4,8-10,12-15,17H2,(H4,32,33,37)(H2,35,38,39,43);1-3,5-7,11,15H,4,8-10,12-14,16H2,(H4,30,31,35)(H2,33,36,37,42);3-4,13H,5-12,14H2,1-2H3,(H4,28,29,32)(H2,30,33,34,40);12H,3-11H2,1-2H3,(H4,26,27,33)(H2,28,34,35,39);1-2,4,6,14H,3,5,7-12H2,(H,29,36)(H4,26,27,31)(H2,28,32,33,37);1-2,4-5H,3,6-13H2,(H4,26,27,31)(H,29,32,35)
InChIKeyFZFZXNPWXVHFFI-UHFFFAOYSA-N
MW3462.43 g/mol
LogP8.34
Rot. Bonds35

About 3,5-diamino-N-[8-[4-(1,3-benzothiazol-2-yl)butanoyl]-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[4-(dimethylamino)-7H-pyrrolo[3,2-d]pyrimidin-6-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[5-(dimethylsulfamoyl)-2,3-dihydroindol-1-yl]-4-oxobutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-1,3-dihydroindol-3-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-3-pyridin-3-ylbenzimidazol-1-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[2-oxo-3-(pyridin-3-ylmethyl)-3H-indol-1-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide

3,5-diamino-N-[8-[4-(1,3-benzothiazol-2-yl)butanoyl]-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[4-(dimethylamino)-7H-pyrrolo[3,2-d]pyrimidin-6-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[5-(dimethylsulfamoyl)-2,3-dihydroindol-1-yl]-4-oxobutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-1,3-dihydroindol-3-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-3-pyridin-3-ylbenzimidazol-1-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[2-oxo-3-(pyridin-3-ylmethyl)-3H-indol-1-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide (PubChem CID 158186854) has the molecular formula C156H182Cl6N60O18S2 and a molecular weight of 3462.43 g/mol. Its IUPAC name is 3,5-diamino-N-[8-[4-(1,3-benzothiazol-2-yl)butanoyl]-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[4-(dimethylamino)-7H-pyrrolo[3,2-d]pyrimidin-6-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[5-(dimethylsulfamoyl)-2,3-dihydroindol-1-yl]-4-oxobutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-1,3-dihydroindol-3-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-3-pyridin-3-ylbenzimidazol-1-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[2-oxo-3-(pyridin-3-ylmethyl)-3H-indol-1-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide.

Molecular Properties

Compound Name3,5-diamino-N-[8-[4-(1,3-benzothiazol-2-yl)butanoyl]-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[4-(dimethylamino)-7H-pyrrolo[3,2-d]pyrimidin-6-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[5-(dimethylsulfamoyl)-2,3-dihydroindol-1-yl]-4-oxobutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-1,3-dihydroindol-3-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-3-pyridin-3-ylbenzimidazol-1-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[2-oxo-3-(pyridin-3-ylmethyl)-3H-indol-1-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide
PubChem CID158186854
Molecular FormulaC156H182Cl6N60O18S2
Molecular Weight3462.43 g/mol
Exact Mass3457.27
IUPAC Name3,5-diamino-N-[8-[4-(1,3-benzothiazol-2-yl)butanoyl]-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[4-(dimethylamino)-7H-pyrrolo[3,2-d]pyrimidin-6-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[5-(dimethylsulfamoyl)-2,3-dihydroindol-1-yl]-4-oxobutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-1,3-dihydroindol-3-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-3-pyridin-3-ylbenzimidazol-1-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[2-oxo-3-(pyridin-3-ylmethyl)-3H-indol-1-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide
SMILESCN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)CCC(=O)N1CCC2(CC1)CN=C(NC(=O)c1nc(Cl)c(N)nc1N)N2.CN(C)c1ncnc2c1N=C(CCCC(=O)N1CCC3(CC1)CN=C(NC(=O)c1nc(Cl)c(N)nc1N)N3)C2.Nc1nc(N)c(C(=O)NC2=NC3(CC2)CCN(C(=O)CCCc2nc4ccccc4s2)CC3)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)CCCC4C(=O)Nc5ccccc54)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)CCCN4C(=O)C(Cc5cccnc5)c5ccccc54)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)CCCn4c(=O)n(-c5cccnc5)c5ccccc54)CC3)N2)nc1Cl
InChIInChI=1S/C30H33ClN10O3.C28H30ClN11O3.C26H33ClN10O5S.C24H31ClN12O2.C24H28ClN9O3.C24H27ClN8O2S/c31-24-26(33)37-25(32)23(36-24)27(43)38-29-35-17-30(39-29)9-13-40(14-10-30)22(42)8-4-12-41-21-7-2-1-6-19(21)20(28(41)44)15-18-5-3-11-34-16-18;29-22-24(31)35-23(30)21(34-22)25(42)36-26-33-16-28(37-26)9-13-38(14-10-28)20(41)8-4-12-39-18-6-1-2-7-19(18)40(27(39)43)17-5-3-11-32-15-17;1-35(2)43(41,42)16-3-4-17-15(13-16)7-10-37(17)19(39)6-5-18(38)36-11-8-26(9-12-36)14-30-25(34-26)33-24(40)20-22(28)32-23(29)21(27)31-20;1-36(2)21-16-14(29-12-30-21)10-13(31-16)4-3-5-15(38)37-8-6-24(7-9-37)11-28-23(35-24)34-22(39)17-19(26)33-20(27)18(25)32-17;25-18-20(27)31-19(26)17(30-18)22(37)32-23-28-12-24(33-23)8-10-34(11-9-24)16(35)7-3-5-14-13-4-1-2-6-15(13)29-21(14)36;25-20-22(27)31-21(26)19(30-20)23(35)29-16-8-9-24(32-16)10-12-33(13-11-24)18(34)7-3-6-17-28-14-4-1-2-5-15(14)36-17/h1-3,5-7,11,16,20H,4,8-10,12-15,17H2,(H4,32,33,37)(H2,35,38,39,43);1-3,5-7,11,15H,4,8-10,12-14,16H2,(H4,30,31,35)(H2,33,36,37,42);3-4,13H,5-12,14H2,1-2H3,(H4,28,29,32)(H2,30,33,34,40);12H,3-11H2,1-2H3,(H4,26,27,33)(H2,28,34,35,39);1-2,4,6,14H,3,5,7-12H2,(H,29,36)(H4,26,27,31)(H2,28,32,33,37);1-2,4-5H,3,6-13H2,(H4,26,27,31)(H,29,32,35)
InChIKeyFZFZXNPWXVHFFI-UHFFFAOYSA-N
XLogP8.34
TPSA1111.77 Ų
H-Bond Donors24
H-Bond Acceptors63
Rotatable Bonds35
Heavy Atoms242
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003462.43
LogP ≤ 58.34
H-Bond Donors ≤ 524
H-Bond Acceptors ≤ 1063

Analyze 3,5-diamino-N-[8-[4-(1,3-benzothiazol-2-yl)butanoyl]-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[4-(dimethylamino)-7H-pyrrolo[3,2-d]pyrimidin-6-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[5-(dimethylsulfamoyl)-2,3-dihydroindol-1-yl]-4-oxobutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-1,3-dihydroindol-3-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-3-pyridin-3-ylbenzimidazol-1-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[2-oxo-3-(pyridin-3-ylmethyl)-3H-indol-1-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide with MolForge

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Related Compounds

N-[8-[2-acetamido-3-(1H-indol-3-yl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-3,5-diamino-6-chloropyrazine-2-carboxamide;3,5-diamino-N-[8-(1-benzyl-5-oxopyrrolidine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[(diethylsulfamoylamino)methyl]cyclohexanecarbonyl]-1,8-diazaspiro[4.5]dec-1-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[4-[(4,6-dimethylpyrimidin-2-yl)methylsulfonyl]anilino]-4-oxobutanoyl]-1,8-diazaspiro[4.5]dec-1-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-oxo-5-(4-sulfamoylphenyl)pentanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide
CID 158959193
N-[8-[(2R)-2-acetamido-3-(1H-indol-3-yl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-3,5-diamino-6-chloropyrazine-2-carboxamide;3,5-diamino-N-[8-(1-benzyl-5-oxopyrrolidine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[(diethylsulfamoylamino)methyl]cyclohexanecarbonyl]-1,8-diazaspiro[4.5]dec-1-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[4-[(4,6-dimethylpyrimidin-2-yl)methylsulfonyl]anilino]-4-oxobutanoyl]-1,8-diazaspiro[4.5]dec-1-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-oxo-5-(4-sulfamoylphenyl)pentanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide
CID 158959194
CID 157081340
CID 157081340
(2S)-N-[(1S)-1-cyclohexyl-2-oxo-2-[(2S)-2-(7-phenyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)pyrrolidin-1-yl]ethyl]-2-(methylamino)propanamide;(2S)-N-[(1S)-1-cyclohexyl-2-oxo-2-[(2S)-2-(4-phenyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)pyrrolidin-1-yl]ethyl]-2-(methylamino)propanamide;(2S)-N-[(1S)-1-(1,1-dioxothian-4-yl)-2-oxo-2-[(2S)-2-(4-phenyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)pyrrolidin-1-yl]ethyl]-2-(methylamino)propanamide;(2S)-2-(methylamino)-N-[(1S)-2-oxo-2-[(2S)-2-(4-phenyl-1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-1-piperidin-4-ylethyl]propanamide;(2S)-2-(methylamino)-N-[(1S)-2-oxo-2-[2-(7-phenyl-[1,3]thiazolo[5,4-d]pyrimidin-2-yl)pyrrolidin-1-yl]-1-pyridin-3-ylethyl]propanamide
CID 157423677
3,5-diamino-N-[8-[1-(benzenesulfonyl)indole-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-N-[8-[2-(1-benzothiophen-3-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(5-methyl-4H-pyrazol-3-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[5-oxo-1-(3-pyrrol-1-ylpropyl)pyrrolidine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-pentylsulfonylbenzoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(propan-2-ylcarbamoylamino)benzoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide
CID 157611454
CID 157893064
CID 157893064
3,5-diamino-N-[8-[1-(benzenesulfonyl)indole-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-N-[8-[2-(1-benzothiophen-3-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-N-[8-[3-(butylsulfamoyl)benzoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(5-methyl-1H-1,2,4-triazol-3-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[5-oxo-1-(3-pyrrol-1-ylpropyl)pyrrolidine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(propan-2-ylcarbamoylamino)benzoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide
CID 158137912
CID 158378747
CID 158378747
CID 158835201
CID 158835201
3,5-diamino-N-[8-[4-(1,3-benzothiazol-2-yl)butanoyl]-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;2,6-diamino-5-chloro-N-[8-[4-[4-(dimethylamino)-7H-pyrrolo[3,2-d]pyrimidin-6-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyridine-3-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[5-(dimethylsulfamoyl)-2,3-dihydroindol-1-yl]-4-oxobutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2H-indazol-3-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(5-methylsulfonyl-2,3-dihydroindol-1-yl)-4-oxobutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-1,3-dihydroindol-3-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide
CID 158865968
4-(1,3-benzothiazol-2-yl)-1-[(2E)-2-[2-(3,5-diamino-6-chloropyrazin-2-yl)-2-oxoethylidene]-1,8-diazaspiro[4.5]decan-8-yl]butan-1-one;3,5-diamino-6-chloro-N-[8-[4-[5-(dimethylsulfamoyl)-2,3-dihydroindol-1-yl]-4-oxobutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2H-indazol-3-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(5-methylsulfonyl-2,3-dihydroindol-1-yl)-4-oxobutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide
CID 159339777
3,5-diamino-N-[8-[1-(benzenesulfonyl)indole-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-N-[8-[2-(1-benzothiophen-3-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[5-oxo-1-(3-pyrrol-1-ylpropyl)pyrrolidine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(5-phenyl-4H-pyrazol-3-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(propan-2-ylcarbamoylamino)benzoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;2,4-diamino-N-[8-[3-(4-propan-2-yloxybutylsulfonyl)benzoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrimidin-1-ium-5-carboxamide;chloride
CID 159377751

Frequently Asked Questions

What is the IUPAC name of 3,5-diamino-N-[8-[4-(1,3-benzothiazol-2-yl)butanoyl]-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[4-(dimethylamino)-7H-pyrrolo[3,2-d]pyrimidin-6-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[5-(dimethylsulfamoyl)-2,3-dihydroindol-1-yl]-4-oxobutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-1,3-dihydroindol-3-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-3-pyridin-3-ylbenzimidazol-1-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[2-oxo-3-(pyridin-3-ylmethyl)-3H-indol-1-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide?
The IUPAC name of 3,5-diamino-N-[8-[4-(1,3-benzothiazol-2-yl)butanoyl]-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[4-(dimethylamino)-7H-pyrrolo[3,2-d]pyrimidin-6-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[5-(dimethylsulfamoyl)-2,3-dihydroindol-1-yl]-4-oxobutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-1,3-dihydroindol-3-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-3-pyridin-3-ylbenzimidazol-1-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[2-oxo-3-(pyridin-3-ylmethyl)-3H-indol-1-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide (CID 158186854) is 3,5-diamino-N-[8-[4-(1,3-benzothiazol-2-yl)butanoyl]-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[4-(dimethylamino)-7H-pyrrolo[3,2-d]pyrimidin-6-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[5-(dimethylsulfamoyl)-2,3-dihydroindol-1-yl]-4-oxobutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-1,3-dihydroindol-3-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-3-pyridin-3-ylbenzimidazol-1-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[2-oxo-3-(pyridin-3-ylmethyl)-3H-indol-1-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide.
What is the SMILES notation for 3,5-diamino-N-[8-[4-(1,3-benzothiazol-2-yl)butanoyl]-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[4-(dimethylamino)-7H-pyrrolo[3,2-d]pyrimidin-6-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[5-(dimethylsulfamoyl)-2,3-dihydroindol-1-yl]-4-oxobutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-1,3-dihydroindol-3-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-3-pyridin-3-ylbenzimidazol-1-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[2-oxo-3-(pyridin-3-ylmethyl)-3H-indol-1-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide?
The canonical SMILES for 3,5-diamino-N-[8-[4-(1,3-benzothiazol-2-yl)butanoyl]-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[4-(dimethylamino)-7H-pyrrolo[3,2-d]pyrimidin-6-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[5-(dimethylsulfamoyl)-2,3-dihydroindol-1-yl]-4-oxobutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-1,3-dihydroindol-3-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-3-pyridin-3-ylbenzimidazol-1-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[2-oxo-3-(pyridin-3-ylmethyl)-3H-indol-1-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide is CN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)CCC(=O)N1CCC2(CC1)CN=C(NC(=O)c1nc(Cl)c(N)nc1N)N2.CN(C)c1ncnc2c1N=C(CCCC(=O)N1CCC3(CC1)CN=C(NC(=O)c1nc(Cl)c(N)nc1N)N3)C2.Nc1nc(N)c(C(=O)NC2=NC3(CC2)CCN(C(=O)CCCc2nc4ccccc4s2)CC3)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)CCCC4C(=O)Nc5ccccc54)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)CCCN4C(=O)C(Cc5cccnc5)c5ccccc54)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)CCCn4c(=O)n(-c5cccnc5)c5ccccc54)CC3)N2)nc1Cl.
What is the InChIKey of 3,5-diamino-N-[8-[4-(1,3-benzothiazol-2-yl)butanoyl]-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[4-(dimethylamino)-7H-pyrrolo[3,2-d]pyrimidin-6-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[5-(dimethylsulfamoyl)-2,3-dihydroindol-1-yl]-4-oxobutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-1,3-dihydroindol-3-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-3-pyridin-3-ylbenzimidazol-1-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[2-oxo-3-(pyridin-3-ylmethyl)-3H-indol-1-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide?
The InChIKey is FZFZXNPWXVHFFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H33ClN10O3.C28H30ClN11O3.C26H33ClN10O5S.C24H31ClN12O2.C24H28ClN9O3.C24H27ClN8O2S/c31-24-26(33)37-25(32)23(36-24)27(43)38-29-35-17-30(39-29)9-13-40(14-10-30)22(42)8-4-12-41-21-7-2-1-6-19(21)20(28(41)44)15-18-5-3-11-34-16-18;29-22-24(31)35-23(30)21(34-22)25(42)36-26-33-16-28(37-26)9-13-38(14-10-28)20(41)8-4-12-39-18-6-1-2-7-19(18)40(27(39)43)17-5-3-11-32-15-17;1-35(2)43(41,42)16-3-4-17-15(13-16)7-10-37(17)19(39)6-5-18(38)36-11-8-26(9-12-36)14-30-25(34-26)33-24(40)20-22(28)32-23(29)21(27)31-20;1-36(2)21-16-14(29-12-30-21)10-13(31-16)4-3-5-15(38)37-8-6-24(7-9-37)11-28-23(35-24)34-22(39)17-19(26)33-20(27)18(25)32-17;25-18-20(27)31-19(26)17(30-18)22(37)32-23-28-12-24(33-23)8-10-34(11-9-24)16(35)7-3-5-14-13-4-1-2-6-15(13)29-21(14)36;25-20-22(27)31-21(26)19(30-20)23(35)29-16-8-9-24(32-16)10-12-33(13-11-24)18(34)7-3-6-17-28-14-4-1-2-5-15(14)36-17/h1-3,5-7,11,16,20H,4,8-10,12-15,17H2,(H4,32,33,37)(H2,35,38,39,43);1-3,5-7,11,15H,4,8-10,12-14,16H2,(H4,30,31,35)(H2,33,36,37,42);3-4,13H,5-12,14H2,1-2H3,(H4,28,29,32)(H2,30,33,34,40);12H,3-11H2,1-2H3,(H4,26,27,33)(H2,28,34,35,39);1-2,4,6,14H,3,5,7-12H2,(H,29,36)(H4,26,27,31)(H2,28,32,33,37);1-2,4-5H,3,6-13H2,(H4,26,27,31)(H,29,32,35).
What are the key properties of 3,5-diamino-N-[8-[4-(1,3-benzothiazol-2-yl)butanoyl]-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[4-(dimethylamino)-7H-pyrrolo[3,2-d]pyrimidin-6-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[5-(dimethylsulfamoyl)-2,3-dihydroindol-1-yl]-4-oxobutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-1,3-dihydroindol-3-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-3-pyridin-3-ylbenzimidazol-1-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[2-oxo-3-(pyridin-3-ylmethyl)-3H-indol-1-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide?
3,5-diamino-N-[8-[4-(1,3-benzothiazol-2-yl)butanoyl]-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[4-(dimethylamino)-7H-pyrrolo[3,2-d]pyrimidin-6-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[5-(dimethylsulfamoyl)-2,3-dihydroindol-1-yl]-4-oxobutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-1,3-dihydroindol-3-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-3-pyridin-3-ylbenzimidazol-1-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[2-oxo-3-(pyridin-3-ylmethyl)-3H-indol-1-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide has a molecular weight of 3462.43 g/mol, XLogP of 8.34, 35 rotatable bonds, 24 hydrogen bond donors, and 63 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-diamino-N-[8-[4-(1,3-benzothiazol-2-yl)butanoyl]-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[4-(dimethylamino)-7H-pyrrolo[3,2-d]pyrimidin-6-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[5-(dimethylsulfamoyl)-2,3-dihydroindol-1-yl]-4-oxobutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-1,3-dihydroindol-3-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-(2-oxo-3-pyridin-3-ylbenzimidazol-1-yl)butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[2-oxo-3-(pyridin-3-ylmethyl)-3H-indol-1-yl]butanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide is sourced from PubChem (CID 158186854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).