1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole

C271H310N16S8 — CID 157133434

IUPAC1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole
SMILESC=C(c1ccc(Cc2nccs2)cc1)c1cc2c(cc1C)C(C)(C)C=CC2(C)C.C=C(c1ccc(Cc2nccs2)cc1)c1cc2c(cc1C)C(C)(C)CCC2(C)C.C=C(c1ccc(Cc2nccs2)cn1)c1cc2c(cc1C)C(C)(C)C=CC2(C)C.C=C(c1ccc(Cc2nccs2)cn1)c1cc2c(cc1C)C(C)(C)CCC2(C)C.C=C(c1ccc(Cn2ccnc2)cc1)c1cc2c(cc1C)C(C)(C)CCC2(C)C.Cc1cc2c(cc1C1(c3ccc(Cc4nccs4)cc3)CC1)C(C)(C)C=CC2(C)C.Cc1cc2c(cc1C1(c3ccc(Cc4nccs4)cc3)CC1)C(C)(C)CCC2(C)C.Cc1cc2c(cc1C1(c3ccc(Cc4nccs4)cn3)CC1)C(C)(C)C=CC2(C)C.Cc1cc2c(cc1C1(c3ccc(Cc4nccs4)cn3)CC1)C(C)(C)CCC2(C)C.Cc1cc2c(cc1C1(c3ccc(Cn4ccnc4)cc3)CC1)C(C)(C)CCC2(C)C
InChIInChI=1S/C28H34N2.C28H33NS.C28H31NS.C27H32N2S.C27H30N2S.C27H32N2.C27H31NS.C27H29NS.C26H30N2S.C26H28N2S/c1-20-16-24-25(27(4,5)11-10-26(24,2)3)17-23(20)28(12-13-28)22-8-6-21(7-9-22)18-30-15-14-29-19-30;2*1-19-16-23-24(27(4,5)11-10-26(23,2)3)18-22(19)28(12-13-28)21-8-6-20(7-9-21)17-25-29-14-15-30-25;2*1-18-14-21-22(26(4,5)9-8-25(21,2)3)16-20(18)27(10-11-27)23-7-6-19(17-29-23)15-24-28-12-13-30-24;1-19-15-24-25(27(5,6)12-11-26(24,3)4)16-23(19)20(2)22-9-7-21(8-10-22)17-29-14-13-28-18-29;2*1-18-15-23-24(27(5,6)12-11-26(23,3)4)17-22(18)19(2)21-9-7-20(8-10-21)16-25-28-13-14-29-25;2*1-17-13-21-22(26(5,6)10-9-25(21,3)4)15-20(17)18(2)23-8-7-19(16-28-23)14-24-27-11-12-29-24/h6-9,14-17,19H,10-13,18H2,1-5H3;6-9,14-16,18H,10-13,17H2,1-5H3;6-11,14-16,18H,12-13,17H2,1-5H3;6-7,12-14,16-17H,8-11,15H2,1-5H3;6-9,12-14,16-17H,10-11,15H2,1-5H3;7-10,13-16,18H,2,11-12,17H2,1,3-6H3;7-10,13-15,17H,2,11-12,16H2,1,3-6H3;7-15,17H,2,16H2,1,3-6H3;7-8,11-13,15-16H,2,9-10,14H2,1,3-6H3;7-13,15-16H,2,14H2,1,3-6H3
InChIKeyAJILYOXLOCIREQ-UHFFFAOYSA-N
MW4048.11 g/mol
LogP69.70
Rot. Bonds40

About 1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole

1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole (PubChem CID 157133434) has the molecular formula C271H310N16S8 and a molecular weight of 4048.11 g/mol. Its IUPAC name is 1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole.

Molecular Properties

Compound Name1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole
PubChem CID157133434
Molecular FormulaC271H310N16S8
Molecular Weight4048.11 g/mol
Exact Mass4044.25
IUPAC Name1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole
SMILESC=C(c1ccc(Cc2nccs2)cc1)c1cc2c(cc1C)C(C)(C)C=CC2(C)C.C=C(c1ccc(Cc2nccs2)cc1)c1cc2c(cc1C)C(C)(C)CCC2(C)C.C=C(c1ccc(Cc2nccs2)cn1)c1cc2c(cc1C)C(C)(C)C=CC2(C)C.C=C(c1ccc(Cc2nccs2)cn1)c1cc2c(cc1C)C(C)(C)CCC2(C)C.C=C(c1ccc(Cn2ccnc2)cc1)c1cc2c(cc1C)C(C)(C)CCC2(C)C.Cc1cc2c(cc1C1(c3ccc(Cc4nccs4)cc3)CC1)C(C)(C)C=CC2(C)C.Cc1cc2c(cc1C1(c3ccc(Cc4nccs4)cc3)CC1)C(C)(C)CCC2(C)C.Cc1cc2c(cc1C1(c3ccc(Cc4nccs4)cn3)CC1)C(C)(C)C=CC2(C)C.Cc1cc2c(cc1C1(c3ccc(Cc4nccs4)cn3)CC1)C(C)(C)CCC2(C)C.Cc1cc2c(cc1C1(c3ccc(Cn4ccnc4)cc3)CC1)C(C)(C)CCC2(C)C
InChIInChI=1S/C28H34N2.C28H33NS.C28H31NS.C27H32N2S.C27H30N2S.C27H32N2.C27H31NS.C27H29NS.C26H30N2S.C26H28N2S/c1-20-16-24-25(27(4,5)11-10-26(24,2)3)17-23(20)28(12-13-28)22-8-6-21(7-9-22)18-30-15-14-29-19-30;2*1-19-16-23-24(27(4,5)11-10-26(23,2)3)18-22(19)28(12-13-28)21-8-6-20(7-9-21)17-25-29-14-15-30-25;2*1-18-14-21-22(26(4,5)9-8-25(21,2)3)16-20(18)27(10-11-27)23-7-6-19(17-29-23)15-24-28-12-13-30-24;1-19-15-24-25(27(5,6)12-11-26(24,3)4)16-23(19)20(2)22-9-7-21(8-10-22)17-29-14-13-28-18-29;2*1-18-15-23-24(27(5,6)12-11-26(23,3)4)17-22(18)19(2)21-9-7-20(8-10-21)16-25-28-13-14-29-25;2*1-17-13-21-22(26(5,6)10-9-25(21,3)4)15-20(17)18(2)23-8-7-19(16-28-23)14-24-27-11-12-29-24/h6-9,14-17,19H,10-13,18H2,1-5H3;6-9,14-16,18H,10-13,17H2,1-5H3;6-11,14-16,18H,12-13,17H2,1-5H3;6-7,12-14,16-17H,8-11,15H2,1-5H3;6-9,12-14,16-17H,10-11,15H2,1-5H3;7-10,13-16,18H,2,11-12,17H2,1,3-6H3;7-10,13-15,17H,2,11-12,16H2,1,3-6H3;7-15,17H,2,16H2,1,3-6H3;7-8,11-13,15-16H,2,9-10,14H2,1,3-6H3;7-13,15-16H,2,14H2,1,3-6H3
InChIKeyAJILYOXLOCIREQ-UHFFFAOYSA-N
XLogP69.70
TPSA190.32 Ų
H-Bond Donors
H-Bond Acceptors24
Rotatable Bonds40
Heavy Atoms295
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004048.11
LogP ≤ 569.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1024

Analyze 1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole?
The IUPAC name of 1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole (CID 157133434) is 1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole.
What is the SMILES notation for 1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole?
The canonical SMILES for 1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole is C=C(c1ccc(Cc2nccs2)cc1)c1cc2c(cc1C)C(C)(C)C=CC2(C)C.C=C(c1ccc(Cc2nccs2)cc1)c1cc2c(cc1C)C(C)(C)CCC2(C)C.C=C(c1ccc(Cc2nccs2)cn1)c1cc2c(cc1C)C(C)(C)C=CC2(C)C.C=C(c1ccc(Cc2nccs2)cn1)c1cc2c(cc1C)C(C)(C)CCC2(C)C.C=C(c1ccc(Cn2ccnc2)cc1)c1cc2c(cc1C)C(C)(C)CCC2(C)C.Cc1cc2c(cc1C1(c3ccc(Cc4nccs4)cc3)CC1)C(C)(C)C=CC2(C)C.Cc1cc2c(cc1C1(c3ccc(Cc4nccs4)cc3)CC1)C(C)(C)CCC2(C)C.Cc1cc2c(cc1C1(c3ccc(Cc4nccs4)cn3)CC1)C(C)(C)C=CC2(C)C.Cc1cc2c(cc1C1(c3ccc(Cc4nccs4)cn3)CC1)C(C)(C)CCC2(C)C.Cc1cc2c(cc1C1(c3ccc(Cn4ccnc4)cc3)CC1)C(C)(C)CCC2(C)C.
What is the InChIKey of 1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole?
The InChIKey is AJILYOXLOCIREQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H34N2.C28H33NS.C28H31NS.C27H32N2S.C27H30N2S.C27H32N2.C27H31NS.C27H29NS.C26H30N2S.C26H28N2S/c1-20-16-24-25(27(4,5)11-10-26(24,2)3)17-23(20)28(12-13-28)22-8-6-21(7-9-22)18-30-15-14-29-19-30;2*1-19-16-23-24(27(4,5)11-10-26(23,2)3)18-22(19)28(12-13-28)21-8-6-20(7-9-21)17-25-29-14-15-30-25;2*1-18-14-21-22(26(4,5)9-8-25(21,2)3)16-20(18)27(10-11-27)23-7-6-19(17-29-23)15-24-28-12-13-30-24;1-19-15-24-25(27(5,6)12-11-26(24,3)4)16-23(19)20(2)22-9-7-21(8-10-22)17-29-14-13-28-18-29;2*1-18-15-23-24(27(5,6)12-11-26(23,3)4)17-22(18)19(2)21-9-7-20(8-10-21)16-25-28-13-14-29-25;2*1-17-13-21-22(26(5,6)10-9-25(21,3)4)15-20(17)18(2)23-8-7-19(16-28-23)14-24-27-11-12-29-24/h6-9,14-17,19H,10-13,18H2,1-5H3;6-9,14-16,18H,10-13,17H2,1-5H3;6-11,14-16,18H,12-13,17H2,1-5H3;6-7,12-14,16-17H,8-11,15H2,1-5H3;6-9,12-14,16-17H,10-11,15H2,1-5H3;7-10,13-16,18H,2,11-12,17H2,1,3-6H3;7-10,13-15,17H,2,11-12,16H2,1,3-6H3;7-15,17H,2,16H2,1,3-6H3;7-8,11-13,15-16H,2,9-10,14H2,1,3-6H3;7-13,15-16H,2,14H2,1,3-6H3.
What are the key properties of 1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole?
1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole has a molecular weight of 4048.11 g/mol, XLogP of 69.70, 40 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;1-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazole;2-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)cyclopropyl]-3-pyridinyl]methyl]-1,3-thiazole;2-[[4-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]phenyl]methyl]-1,3-thiazole;2-[[6-[1-(3,5,5,8,8-pentamethylnaphthalen-2-yl)ethenyl]-3-pyridinyl]methyl]-1,3-thiazole is sourced from PubChem (CID 157133434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).