actinium;cumene;2-ethyl-4-propan-2-yl-1,3-thiazole;2-(fluoromethyl)-4-propan-2-yl-1,3-thiazole;methane;1-methyl-2-propan-2-ylimidazole;2-methyl-4-propan-2-yl-1,3-oxazole;pentakis(2-methyl-4-propan-2-yl-1,3-thiazole);2-methylsulfanyl-4-propan-2-yl-1,3-thiazole;2-piperidin-1-yl-4-propan-2-yl-1,3-thiazole;2-propan-2-ylfuran;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;tris((4-propan-2-yl-1,3-thiazol-2-yl)methanol);bis(2-propan-2-ylthiophene)

C173H293Ac2FN20O5S17 — CID 161157122

IUPACactinium;cumene;2-ethyl-4-propan-2-yl-1,3-thiazole;2-(fluoromethyl)-4-propan-2-yl-1,3-thiazole;methane;1-methyl-2-propan-2-ylimidazole;2-methyl-4-propan-2-yl-1,3-oxazole;pentakis(2-methyl-4-propan-2-yl-1,3-thiazole);2-methylsulfanyl-4-propan-2-yl-1,3-thiazole;2-piperidin-1-yl-4-propan-2-yl-1,3-thiazole;2-propan-2-ylfuran;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;tris((4-propan-2-yl-1,3-thiazol-2-yl)methanol);bis(2-propan-2-ylthiophene)
SMILESC.C.C.C.C.C.C.C.C.C.C.C.CC(C)c1ccccc1.CC(C)c1ccccn1.CC(C)c1cccnc1.CC(C)c1ccco1.CC(C)c1cccs1.CC(C)c1cccs1.CC(C)c1csc(CF)n1.CC(C)c1csc(CO)n1.CC(C)c1csc(CO)n1.CC(C)c1csc(CO)n1.CC(C)c1csc(N2CCCCC2)n1.CC(C)c1cscn1.CC(C)c1nccn1C.CC(C)c1nccs1.CCc1nc(C(C)C)cs1.CSc1nc(C(C)C)cs1.Cc1nc(C(C)C)co1.Cc1nc(C(C)C)cs1.Cc1nc(C(C)C)cs1.Cc1nc(C(C)C)cs1.Cc1nc(C(C)C)cs1.Cc1nc(C(C)C)cs1.[Ac].[Ac]
InChIInChI=1S/C11H18N2S.C9H12.C8H13NS.2C8H11N.C7H10FNS.C7H12N2.3C7H11NOS.C7H11NO.C7H11NS2.5C7H11NS.C7H10O.2C7H10S.2C6H9NS.12CH4.2Ac/c1-9(2)10-8-14-11(12-10)13-6-4-3-5-7-13;1-8(2)9-6-4-3-5-7-9;1-4-8-9-7(5-10-8)6(2)3;1-7(2)8-4-3-5-9-6-8;1-7(2)8-5-3-4-6-9-8;1-5(2)6-4-10-7(3-8)9-6;1-6(2)7-8-4-5-9(7)3;3*1-5(2)6-4-10-7(3-9)8-6;1-5(2)7-4-9-6(3)8-7;1-5(2)6-4-10-7(8-6)9-3;5*1-5(2)7-4-9-6(3)8-7;3*1-6(2)7-4-3-5-8-7;1-5(2)6-3-8-4-7-6;1-5(2)6-7-3-4-8-6;;;;;;;;;;;;;;/h8-9H,3-7H2,1-2H3;3-8H,1-2H3;5-6H,4H2,1-3H3;2*3-7H,1-2H3;4-5H,3H2,1-2H3;4-6H,1-3H3;3*4-5,9H,3H2,1-2H3;4-5H,1-3H3;4-5H,1-3H3;5*4-5H,1-3H3;3*3-6H,1-2H3;2*3-5H,1-2H3;12*1H4;;
InChIKeyIPRAHBZONGZNMA-UHFFFAOYSA-N
MW3751.52 g/mol
LogP61.14
Rot. Bonds29

About actinium;cumene;2-ethyl-4-propan-2-yl-1,3-thiazole;2-(fluoromethyl)-4-propan-2-yl-1,3-thiazole;methane;1-methyl-2-propan-2-ylimidazole;2-methyl-4-propan-2-yl-1,3-oxazole;pentakis(2-methyl-4-propan-2-yl-1,3-thiazole);2-methylsulfanyl-4-propan-2-yl-1,3-thiazole;2-piperidin-1-yl-4-propan-2-yl-1,3-thiazole;2-propan-2-ylfuran;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;tris((4-propan-2-yl-1,3-thiazol-2-yl)methanol);bis(2-propan-2-ylthiophene)

actinium;cumene;2-ethyl-4-propan-2-yl-1,3-thiazole;2-(fluoromethyl)-4-propan-2-yl-1,3-thiazole;methane;1-methyl-2-propan-2-ylimidazole;2-methyl-4-propan-2-yl-1,3-oxazole;pentakis(2-methyl-4-propan-2-yl-1,3-thiazole);2-methylsulfanyl-4-propan-2-yl-1,3-thiazole;2-piperidin-1-yl-4-propan-2-yl-1,3-thiazole;2-propan-2-ylfuran;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;tris((4-propan-2-yl-1,3-thiazol-2-yl)methanol);bis(2-propan-2-ylthiophene) (PubChem CID 161157122) has the molecular formula C173H293Ac2FN20O5S17 and a molecular weight of 3751.52 g/mol. Its IUPAC name is actinium;cumene;2-ethyl-4-propan-2-yl-1,3-thiazole;2-(fluoromethyl)-4-propan-2-yl-1,3-thiazole;methane;1-methyl-2-propan-2-ylimidazole;2-methyl-4-propan-2-yl-1,3-oxazole;pentakis(2-methyl-4-propan-2-yl-1,3-thiazole);2-methylsulfanyl-4-propan-2-yl-1,3-thiazole;2-piperidin-1-yl-4-propan-2-yl-1,3-thiazole;2-propan-2-ylfuran;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;tris((4-propan-2-yl-1,3-thiazol-2-yl)methanol);bis(2-propan-2-ylthiophene).

Molecular Properties

Compound Nameactinium;cumene;2-ethyl-4-propan-2-yl-1,3-thiazole;2-(fluoromethyl)-4-propan-2-yl-1,3-thiazole;methane;1-methyl-2-propan-2-ylimidazole;2-methyl-4-propan-2-yl-1,3-oxazole;pentakis(2-methyl-4-propan-2-yl-1,3-thiazole);2-methylsulfanyl-4-propan-2-yl-1,3-thiazole;2-piperidin-1-yl-4-propan-2-yl-1,3-thiazole;2-propan-2-ylfuran;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;tris((4-propan-2-yl-1,3-thiazol-2-yl)methanol);bis(2-propan-2-ylthiophene)
PubChem CID161157122
Molecular FormulaC173H293Ac2FN20O5S17
Molecular Weight3751.52 g/mol
Exact Mass3747.91
IUPAC Nameactinium;cumene;2-ethyl-4-propan-2-yl-1,3-thiazole;2-(fluoromethyl)-4-propan-2-yl-1,3-thiazole;methane;1-methyl-2-propan-2-ylimidazole;2-methyl-4-propan-2-yl-1,3-oxazole;pentakis(2-methyl-4-propan-2-yl-1,3-thiazole);2-methylsulfanyl-4-propan-2-yl-1,3-thiazole;2-piperidin-1-yl-4-propan-2-yl-1,3-thiazole;2-propan-2-ylfuran;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;tris((4-propan-2-yl-1,3-thiazol-2-yl)methanol);bis(2-propan-2-ylthiophene)
SMILESC.C.C.C.C.C.C.C.C.C.C.C.CC(C)c1ccccc1.CC(C)c1ccccn1.CC(C)c1cccnc1.CC(C)c1ccco1.CC(C)c1cccs1.CC(C)c1cccs1.CC(C)c1csc(CF)n1.CC(C)c1csc(CO)n1.CC(C)c1csc(CO)n1.CC(C)c1csc(CO)n1.CC(C)c1csc(N2CCCCC2)n1.CC(C)c1cscn1.CC(C)c1nccn1C.CC(C)c1nccs1.CCc1nc(C(C)C)cs1.CSc1nc(C(C)C)cs1.Cc1nc(C(C)C)co1.Cc1nc(C(C)C)cs1.Cc1nc(C(C)C)cs1.Cc1nc(C(C)C)cs1.Cc1nc(C(C)C)cs1.Cc1nc(C(C)C)cs1.[Ac].[Ac]
InChIInChI=1S/C11H18N2S.C9H12.C8H13NS.2C8H11N.C7H10FNS.C7H12N2.3C7H11NOS.C7H11NO.C7H11NS2.5C7H11NS.C7H10O.2C7H10S.2C6H9NS.12CH4.2Ac/c1-9(2)10-8-14-11(12-10)13-6-4-3-5-7-13;1-8(2)9-6-4-3-5-7-9;1-4-8-9-7(5-10-8)6(2)3;1-7(2)8-4-3-5-9-6-8;1-7(2)8-5-3-4-6-9-8;1-5(2)6-4-10-7(3-8)9-6;1-6(2)7-8-4-5-9(7)3;3*1-5(2)6-4-10-7(3-9)8-6;1-5(2)7-4-9-6(3)8-7;1-5(2)6-4-10-7(8-6)9-3;5*1-5(2)7-4-9-6(3)8-7;3*1-6(2)7-4-3-5-8-7;1-5(2)6-3-8-4-7-6;1-5(2)6-7-3-4-8-6;;;;;;;;;;;;;;/h8-9H,3-7H2,1-2H3;3-8H,1-2H3;5-6H,4H2,1-3H3;2*3-7H,1-2H3;4-5H,3H2,1-2H3;4-6H,1-3H3;3*4-5,9H,3H2,1-2H3;4-5H,1-3H3;4-5H,1-3H3;5*4-5H,1-3H3;3*3-6H,1-2H3;2*3-5H,1-2H3;12*1H4;;
InChIKeyIPRAHBZONGZNMA-UHFFFAOYSA-N
XLogP61.14
TPSA327.16 Ų
H-Bond Donors3
H-Bond Acceptors42
Rotatable Bonds29
Heavy Atoms218
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003751.52
LogP ≤ 561.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1042

Analyze actinium;cumene;2-ethyl-4-propan-2-yl-1,3-thiazole;2-(fluoromethyl)-4-propan-2-yl-1,3-thiazole;methane;1-methyl-2-propan-2-ylimidazole;2-methyl-4-propan-2-yl-1,3-oxazole;pentakis(2-methyl-4-propan-2-yl-1,3-thiazole);2-methylsulfanyl-4-propan-2-yl-1,3-thiazole;2-piperidin-1-yl-4-propan-2-yl-1,3-thiazole;2-propan-2-ylfuran;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;tris((4-propan-2-yl-1,3-thiazol-2-yl)methanol);bis(2-propan-2-ylthiophene) with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[4-(2-acetyl-1,3-thiazol-5-yl)-5-methyl-1,3-thiazol-2-yl]-1-(2,6-difluorophenyl)ethanone;tert-butyl N-[5-isoquinolin-6-yl-4-(1,3-oxazol-5-yl)-1,3-thiazol-2-yl]-N-[2-methyl-3-(4-methylphenyl)propyl]carbamate;1-(2,6-difluorophenyl)-2-[4-(3-methylimidazol-4-yl)-5-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]ethanone;1-(2,6-difluorophenyl)-2-[4-(4-methyl-1,3-oxazol-5-yl)-5-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]ethanone;1-(2,6-difluorophenyl)-2-[4-(1,3-oxazol-5-yl)-5-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]ethanone;ethene;N-[4-(4-methyl-2-pyrazin-2-yl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-N-(morpholin-4-ylmethyl)thiophene-2-carboxamide;sulfane
CID 157174043
cumene;3-cyclopropyl-5-propan-2-yl-1,2,4-oxadiazole;1,3-dimethyl-4-propan-2-ylpyrazole;1,4-dimethyl-3-propan-2-ylpyrazole;1,2-dimethyl-3-propan-2-ylpyrrole;1,4-di(propan-2-yl)pyrazole;1-ethyl-4-propan-2-ylpyrazole;2-ethyl-5-propan-2-ylthiophene;1-methyl-3-propan-2-ylbenzene;4-methyl-2-propan-2-ylfuran;4-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;3-methyl-1-propan-2-ylpyrazole;4-methyl-1-propan-2-ylpyrazole;1-methyl-3-propan-2-ylpyrrole;2-methyl-5-propan-2-yl-3H-pyrrole;3-methyl-1-propan-2-ylpyrrole;2-methyl-5-propan-2-yl-1,3-thiazole;5-propan-2-yl-3-propyl-1,2,4-oxadiazole;bis(1-propan-2-ylpyrazole);2-[(4-propan-2-ylpyrazol-1-yl)methyl]pyridine;3-propan-2-ylpyridine;4-propan-2-yl-1-(2,2,2-trifluoroethyl)pyrazole
CID 158110433
2-Amino-5-[2-fluoro-5-(furan-3-yl)phenyl]-3-methyl-5-[6-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[2-fluoro-5-(2-methylpyrimidin-5-yl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;2-amino-5-[2-fluoro-5-(1,3-oxazol-4-yl)phenyl]-3-methyl-5-[6-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[2-fluoro-5-(1,3-oxazol-5-yl)phenyl]-3-methyl-5-[4-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[2-fluoro-5-(1,3-thiazol-5-yl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;2-amino-5-(2-fluoro-5-thiophen-3-ylphenyl)-3-methyl-5-[6-(trifluoromethyl)-2-pyridinyl]imidazol-4-one
CID 158760585
1-Benzyl-4-propan-2-ylpyrazole;5-tert-butyl-3-(2,2-difluoropropyl)-1,2-oxazole;4-tert-butyl-1-(2,2-difluoropropyl)pyrazole;5-tert-butyl-3-(1-fluoroethyl)-1,2,4-oxadiazole;2-tert-butyl-4-methylfuran;2-tert-butyl-4-methyl-1,3-oxazole;5-tert-butyl-2-methyl-1,3-thiazole;1,3-dimethyl-4-propan-2-ylpyrazole;2,4-dimethyl-5-propan-2-yltriazole;1,4-di(propan-2-yl)pyrazole;1,3-di(propan-2-yl)-1,2,4-triazole;1-fluoro-3-propan-2-ylbenzene;2-methyl-5-propan-2-ylfuran;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;4-methyl-2-propan-2-ylthiophene;(5-propan-2-yl-1,2-oxazol-3-yl)methanol;4-[2-(4-propan-2-ylpyrazol-1-yl)ethyl]morpholine;3-propan-2-ylpyridine
CID 159414944
1-Benzyl-4-propan-2-ylpyrazole;5-tert-butyl-3-(2,2-difluoropropyl)-1,2-oxazole;4-tert-butyl-1-(2,2-difluoropropyl)pyrazole;5-tert-butyl-3-(1-fluoroethyl)-1,2,4-oxadiazole;2-tert-butyl-4-methylfuran;2-tert-butyl-5-methylfuran;2-tert-butyl-4-methyl-1,3-oxazole;5-tert-butyl-2-methyl-1,3-thiazole;2-tert-butyl-4-methylthiophene;1,3-dimethyl-4-propan-2-ylpyrazole;1,4-dimethyl-3-propan-2-ylpyrazole;1,4-di(propan-2-yl)pyrazole;1,3-di(propan-2-yl)-1,2,4-triazole;3-ethyl-5-propan-2-yl-1,2-oxazole;4-[2-(4-propan-2-ylpyrazol-1-yl)ethyl]morpholine;3-propan-2-ylpyridine
CID 159443558
6-[4-(1,1-Difluoroethoxy)phenyl]-1-phenyl-3-(trifluoromethyl)imidazo[1,5-a]pyridine;6-(4-methoxyphenyl)-3-(trifluoromethyl)imidazo[1,5-a]pyridine;6-(4-phenoxyphenyl)-3-(trifluoromethyl)imidazo[1,5-a]pyridine;6-phenyl-3-(trifluoromethyl)imidazo[1,5-a]pyridine;2-[3-(trifluoromethyl)imidazo[1,5-a]pyridin-6-yl]-1,3-benzothiazole;2-[3-(trifluoromethyl)imidazo[1,5-a]pyridin-6-yl]-1,3-oxazole;2-[3-(trifluoromethyl)imidazo[1,5-a]pyridin-6-yl]-1,3-thiazole
CID 160025166
6-[4-(1,1-difluoroethoxy)phenyl]-1-phenyl-3-(trifluoromethyl)imidazo[1,5-a]pyridine;6-(4-methoxyphenyl)-3-(trifluoromethyl)imidazo[1,5-a]pyridine;methyl (E)-3-[6-[4-(1,1-difluoroethoxy)phenyl]-3-(trifluoromethyl)imidazo[1,5-a]pyridin-1-yl]prop-2-enoate;6-(4-phenoxyphenyl)-3-(trifluoromethyl)imidazo[1,5-a]pyridine;6-phenyl-3-(trifluoromethyl)imidazo[1,5-a]pyridine;2-[3-(trifluoromethyl)imidazo[1,5-a]pyridin-6-yl]-1,3-benzothiazole;2-[3-(trifluoromethyl)imidazo[1,5-a]pyridin-6-yl]-1,3-oxazole;2-[3-(trifluoromethyl)imidazo[1,5-a]pyridin-6-yl]-1,3-thiazole
CID 160204499
6-[4-(1,1-Difluoroethoxy)phenyl]-1-phenyl-3-(trifluoromethyl)imidazo[1,5-a]pyridine;6-(4-methoxyphenyl)-3-(trifluoromethyl)imidazo[1,5-a]pyridine;6-phenyl-3-(trifluoromethyl)imidazo[1,5-a]pyridine;2-[3-(trifluoromethyl)imidazo[1,5-a]pyridin-6-yl]-1,3-benzothiazole;2-[3-(trifluoromethyl)imidazo[1,5-a]pyridin-6-yl]-1,3-benzoxazole;2-[3-(trifluoromethyl)imidazo[1,5-a]pyridin-6-yl]-1,3-oxazole;2-[3-(trifluoromethyl)imidazo[1,5-a]pyridin-6-yl]-1,3-thiazole
CID 160592384
2-Amino-5-[4-fluoro-3-(2-fluoropyrimidin-5-yl)phenyl]-3-methyl-5-[4-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[4-fluoro-3-(furan-3-yl)phenyl]-3-methyl-5-[4-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[4-fluoro-3-(2-methylpyrimidin-5-yl)phenyl]-3-methyl-5-[4-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[4-fluoro-3-(1,3-oxazol-4-yl)phenyl]-3-methyl-5-[4-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[4-fluoro-3-(1,3-thiazol-4-yl)phenyl]-3-methyl-5-[4-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-(4-fluoro-3-thiophen-3-ylphenyl)-3-methyl-5-[4-(trifluoromethyl)-2-pyridinyl]imidazol-4-one
CID 160685595
4-tert-butyl-2,5-dimethyl-1,3-thiazole;4-tert-butyl-1-(2-methylpropyl)pyrazole;2-tert-butyl-5-methylthiophene;4-[(4-tert-butylthiophen-2-yl)methyl]morpholine;4-tert-butyl-2-(2,2,2-trifluoroethyl)triazole;cumene;2-cyclopropyl-5-propan-2-yl-1,3-oxazole;3-cyclopropyl-1-propan-2-yl-1,2,4-triazole;3,4-dimethyl-1-propan-2-ylpyrazole;N,N-dimethyl-1-(1-propan-2-yl-1,2,4-triazol-3-yl)methanamine;2-ethyl-4-propan-2-yl-1,3-thiazole;5-ethyl-3-propyl-1,2,4-oxadiazole;3-methyl-1-propan-2-ylpyrazole;4-methyl-2-propan-2-ylthiophene;2-[(4-methylpyrazol-1-yl)methyl]pyridine;3-propan-2-ylfuran;4-propan-2-yl-1-propylpyrazole;3-[(4-propan-2-ylpyrazol-1-yl)methyl]pyridine;5-propan-2-yl-3H-pyrrole;2-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene
CID 161459908
2-Amino-5-[3-(furan-3-yl)phenyl]-3-methyl-5-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(2-methylpyrimidin-5-yl)phenyl]-5-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(1,3-oxazol-4-yl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(1,3-oxazol-5-yl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(1,3-thiazol-5-yl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-(3-thiophen-3-ylphenyl)-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one
CID 161609887
1-Methoxy-4-methylbenzene;2-methyl-1,3-benzoxazole;2-methylpyrimidine;2-methyl-[1,3]thiazolo[5,4-b]pyridine;2-methyl-4-thiophen-2-ylpyrimidine;2-methyl-5-(trifluoromethyl)pyridine
CID 161612024

Frequently Asked Questions

What is the IUPAC name of actinium;cumene;2-ethyl-4-propan-2-yl-1,3-thiazole;2-(fluoromethyl)-4-propan-2-yl-1,3-thiazole;methane;1-methyl-2-propan-2-ylimidazole;2-methyl-4-propan-2-yl-1,3-oxazole;pentakis(2-methyl-4-propan-2-yl-1,3-thiazole);2-methylsulfanyl-4-propan-2-yl-1,3-thiazole;2-piperidin-1-yl-4-propan-2-yl-1,3-thiazole;2-propan-2-ylfuran;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;tris((4-propan-2-yl-1,3-thiazol-2-yl)methanol);bis(2-propan-2-ylthiophene)?
The IUPAC name of actinium;cumene;2-ethyl-4-propan-2-yl-1,3-thiazole;2-(fluoromethyl)-4-propan-2-yl-1,3-thiazole;methane;1-methyl-2-propan-2-ylimidazole;2-methyl-4-propan-2-yl-1,3-oxazole;pentakis(2-methyl-4-propan-2-yl-1,3-thiazole);2-methylsulfanyl-4-propan-2-yl-1,3-thiazole;2-piperidin-1-yl-4-propan-2-yl-1,3-thiazole;2-propan-2-ylfuran;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;tris((4-propan-2-yl-1,3-thiazol-2-yl)methanol);bis(2-propan-2-ylthiophene) (CID 161157122) is actinium;cumene;2-ethyl-4-propan-2-yl-1,3-thiazole;2-(fluoromethyl)-4-propan-2-yl-1,3-thiazole;methane;1-methyl-2-propan-2-ylimidazole;2-methyl-4-propan-2-yl-1,3-oxazole;pentakis(2-methyl-4-propan-2-yl-1,3-thiazole);2-methylsulfanyl-4-propan-2-yl-1,3-thiazole;2-piperidin-1-yl-4-propan-2-yl-1,3-thiazole;2-propan-2-ylfuran;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;tris((4-propan-2-yl-1,3-thiazol-2-yl)methanol);bis(2-propan-2-ylthiophene).
What is the SMILES notation for actinium;cumene;2-ethyl-4-propan-2-yl-1,3-thiazole;2-(fluoromethyl)-4-propan-2-yl-1,3-thiazole;methane;1-methyl-2-propan-2-ylimidazole;2-methyl-4-propan-2-yl-1,3-oxazole;pentakis(2-methyl-4-propan-2-yl-1,3-thiazole);2-methylsulfanyl-4-propan-2-yl-1,3-thiazole;2-piperidin-1-yl-4-propan-2-yl-1,3-thiazole;2-propan-2-ylfuran;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;tris((4-propan-2-yl-1,3-thiazol-2-yl)methanol);bis(2-propan-2-ylthiophene)?
The canonical SMILES for actinium;cumene;2-ethyl-4-propan-2-yl-1,3-thiazole;2-(fluoromethyl)-4-propan-2-yl-1,3-thiazole;methane;1-methyl-2-propan-2-ylimidazole;2-methyl-4-propan-2-yl-1,3-oxazole;pentakis(2-methyl-4-propan-2-yl-1,3-thiazole);2-methylsulfanyl-4-propan-2-yl-1,3-thiazole;2-piperidin-1-yl-4-propan-2-yl-1,3-thiazole;2-propan-2-ylfuran;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;tris((4-propan-2-yl-1,3-thiazol-2-yl)methanol);bis(2-propan-2-ylthiophene) is C.C.C.C.C.C.C.C.C.C.C.C.CC(C)c1ccccc1.CC(C)c1ccccn1.CC(C)c1cccnc1.CC(C)c1ccco1.CC(C)c1cccs1.CC(C)c1cccs1.CC(C)c1csc(CF)n1.CC(C)c1csc(CO)n1.CC(C)c1csc(CO)n1.CC(C)c1csc(CO)n1.CC(C)c1csc(N2CCCCC2)n1.CC(C)c1cscn1.CC(C)c1nccn1C.CC(C)c1nccs1.CCc1nc(C(C)C)cs1.CSc1nc(C(C)C)cs1.Cc1nc(C(C)C)co1.Cc1nc(C(C)C)cs1.Cc1nc(C(C)C)cs1.Cc1nc(C(C)C)cs1.Cc1nc(C(C)C)cs1.Cc1nc(C(C)C)cs1.[Ac].[Ac].
What is the InChIKey of actinium;cumene;2-ethyl-4-propan-2-yl-1,3-thiazole;2-(fluoromethyl)-4-propan-2-yl-1,3-thiazole;methane;1-methyl-2-propan-2-ylimidazole;2-methyl-4-propan-2-yl-1,3-oxazole;pentakis(2-methyl-4-propan-2-yl-1,3-thiazole);2-methylsulfanyl-4-propan-2-yl-1,3-thiazole;2-piperidin-1-yl-4-propan-2-yl-1,3-thiazole;2-propan-2-ylfuran;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;tris((4-propan-2-yl-1,3-thiazol-2-yl)methanol);bis(2-propan-2-ylthiophene)?
The InChIKey is IPRAHBZONGZNMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2S.C9H12.C8H13NS.2C8H11N.C7H10FNS.C7H12N2.3C7H11NOS.C7H11NO.C7H11NS2.5C7H11NS.C7H10O.2C7H10S.2C6H9NS.12CH4.2Ac/c1-9(2)10-8-14-11(12-10)13-6-4-3-5-7-13;1-8(2)9-6-4-3-5-7-9;1-4-8-9-7(5-10-8)6(2)3;1-7(2)8-4-3-5-9-6-8;1-7(2)8-5-3-4-6-9-8;1-5(2)6-4-10-7(3-8)9-6;1-6(2)7-8-4-5-9(7)3;3*1-5(2)6-4-10-7(3-9)8-6;1-5(2)7-4-9-6(3)8-7;1-5(2)6-4-10-7(8-6)9-3;5*1-5(2)7-4-9-6(3)8-7;3*1-6(2)7-4-3-5-8-7;1-5(2)6-3-8-4-7-6;1-5(2)6-7-3-4-8-6;;;;;;;;;;;;;;/h8-9H,3-7H2,1-2H3;3-8H,1-2H3;5-6H,4H2,1-3H3;2*3-7H,1-2H3;4-5H,3H2,1-2H3;4-6H,1-3H3;3*4-5,9H,3H2,1-2H3;4-5H,1-3H3;4-5H,1-3H3;5*4-5H,1-3H3;3*3-6H,1-2H3;2*3-5H,1-2H3;12*1H4;;.
What are the key properties of actinium;cumene;2-ethyl-4-propan-2-yl-1,3-thiazole;2-(fluoromethyl)-4-propan-2-yl-1,3-thiazole;methane;1-methyl-2-propan-2-ylimidazole;2-methyl-4-propan-2-yl-1,3-oxazole;pentakis(2-methyl-4-propan-2-yl-1,3-thiazole);2-methylsulfanyl-4-propan-2-yl-1,3-thiazole;2-piperidin-1-yl-4-propan-2-yl-1,3-thiazole;2-propan-2-ylfuran;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;tris((4-propan-2-yl-1,3-thiazol-2-yl)methanol);bis(2-propan-2-ylthiophene)?
actinium;cumene;2-ethyl-4-propan-2-yl-1,3-thiazole;2-(fluoromethyl)-4-propan-2-yl-1,3-thiazole;methane;1-methyl-2-propan-2-ylimidazole;2-methyl-4-propan-2-yl-1,3-oxazole;pentakis(2-methyl-4-propan-2-yl-1,3-thiazole);2-methylsulfanyl-4-propan-2-yl-1,3-thiazole;2-piperidin-1-yl-4-propan-2-yl-1,3-thiazole;2-propan-2-ylfuran;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;tris((4-propan-2-yl-1,3-thiazol-2-yl)methanol);bis(2-propan-2-ylthiophene) has a molecular weight of 3751.52 g/mol, XLogP of 61.14, 29 rotatable bonds, 3 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for actinium;cumene;2-ethyl-4-propan-2-yl-1,3-thiazole;2-(fluoromethyl)-4-propan-2-yl-1,3-thiazole;methane;1-methyl-2-propan-2-ylimidazole;2-methyl-4-propan-2-yl-1,3-oxazole;pentakis(2-methyl-4-propan-2-yl-1,3-thiazole);2-methylsulfanyl-4-propan-2-yl-1,3-thiazole;2-piperidin-1-yl-4-propan-2-yl-1,3-thiazole;2-propan-2-ylfuran;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;tris((4-propan-2-yl-1,3-thiazol-2-yl)methanol);bis(2-propan-2-ylthiophene) is sourced from PubChem (CID 161157122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).