2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;1-chloro-4-propan-2-ylbenzene;cumene;2-cyclopropyl-5-propan-2-yl-1,3,4-thiadiazole;2,3-dimethylbutane;bis(1-fluoro-4-propan-2-ylbenzene);5-fluoro-2-propan-2-ylpyridine;methane;1-methyl-4-(2-methylpropyl)benzene;1-methyl-4-propan-2-ylbenzene;methyl 3-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;1-methyl-3-propan-2-ylpyrazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;bis(2-methylpropylbenzene);2-propan-2-yloxane;1-(2-propan-2-yl-1,3-oxazol-4-yl)ethanone;4-propan-2-yl-1,3-thiazole

C187H306ClF3N12O7S4 — CID 157063479

IUPAC2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;1-chloro-4-propan-2-ylbenzene;cumene;2-cyclopropyl-5-propan-2-yl-1,3,4-thiadiazole;2,3-dimethylbutane;bis(1-fluoro-4-propan-2-ylbenzene);5-fluoro-2-propan-2-ylpyridine;methane;1-methyl-4-(2-methylpropyl)benzene;1-methyl-4-propan-2-ylbenzene;methyl 3-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;1-methyl-3-propan-2-ylpyrazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;bis(2-methylpropylbenzene);2-propan-2-yloxane;1-(2-propan-2-yl-1,3-oxazol-4-yl)ethanone;4-propan-2-yl-1,3-thiazole
SMILESC.C.C.C.C.C.C.C.C.C.C.C.C.CC(=O)c1coc(C(C)C)n1.CC(C)C(C)C.CC(C)C1CCCCO1.CC(C)Cc1ccccc1.CC(C)Cc1ccccc1.CC(C)c1ccc(Cl)cc1.CC(C)c1ccc(F)cc1.CC(C)c1ccc(F)cc1.CC(C)c1ccc(F)cn1.CC(C)c1ccccc1.CC(C)c1ccn(C)n1.CC(C)c1cscn1.CC(C)c1nnc(C(C)(C)C)s1.CC(C)c1nnc(C2CC2)s1.COC(=O)c1ccc(C(C)C)cc1.COC(=O)c1cccc(C(C)C)c1.Cc1ccc(C(C)C)cc1.Cc1ccc(CC(C)C)cc1.Cc1cccc(C(C)C)n1.Cc1nnc(C(C)C)s1
InChIInChI=1S/2C11H14O2.C11H16.3C10H14.C9H11Cl.2C9H11F.C9H16N2S.C9H13N.C9H12.C8H10FN.C8H12N2S.C8H11NO2.C8H16O.C7H12N2.C6H10N2S.C6H9NS.C6H14.13CH4/c1-8(2)9-4-6-10(7-5-9)11(12)13-3;1-8(2)9-5-4-6-10(7-9)11(12)13-3;1-9(2)8-11-6-4-10(3)5-7-11;1-8(2)10-6-4-9(3)5-7-10;2*1-9(2)8-10-6-4-3-5-7-10;3*1-7(2)8-3-5-9(10)6-4-8;1-6(2)7-10-11-8(12-7)9(3,4)5;1-7(2)9-6-4-5-8(3)10-9;1-8(2)9-6-4-3-5-7-9;1-6(2)8-4-3-7(9)5-10-8;1-5(2)7-9-10-8(11-7)6-3-4-6;1-5(2)8-9-7(4-11-8)6(3)10;1-7(2)8-5-3-4-6-9-8;1-6(2)7-4-5-9(3)8-7;1-4(2)6-8-7-5(3)9-6;1-5(2)6-3-8-4-7-6;1-5(2)6(3)4;;;;;;;;;;;;;/h2*4-8H,1-3H3;4-7,9H,8H2,1-3H3;4-8H,1-3H3;2*3-7,9H,8H2,1-2H3;3*3-7H,1-2H3;6H,1-5H3;4-7H,1-3H3;3-8H,1-2H3;3-6H,1-2H3;5-6H,3-4H2,1-2H3;4-5H,1-3H3;7-8H,3-6H2,1-2H3;4-6H,1-3H3;4H,1-3H3;3-5H,1-2H3;5-6H,1-4H3;13*1H4
InChIKeyABPFMRLVAYVLML-UHFFFAOYSA-N
MW3055.30 g/mol
LogP60.36
Rot. Bonds27

About 2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;1-chloro-4-propan-2-ylbenzene;cumene;2-cyclopropyl-5-propan-2-yl-1,3,4-thiadiazole;2,3-dimethylbutane;bis(1-fluoro-4-propan-2-ylbenzene);5-fluoro-2-propan-2-ylpyridine;methane;1-methyl-4-(2-methylpropyl)benzene;1-methyl-4-propan-2-ylbenzene;methyl 3-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;1-methyl-3-propan-2-ylpyrazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;bis(2-methylpropylbenzene);2-propan-2-yloxane;1-(2-propan-2-yl-1,3-oxazol-4-yl)ethanone;4-propan-2-yl-1,3-thiazole

2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;1-chloro-4-propan-2-ylbenzene;cumene;2-cyclopropyl-5-propan-2-yl-1,3,4-thiadiazole;2,3-dimethylbutane;bis(1-fluoro-4-propan-2-ylbenzene);5-fluoro-2-propan-2-ylpyridine;methane;1-methyl-4-(2-methylpropyl)benzene;1-methyl-4-propan-2-ylbenzene;methyl 3-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;1-methyl-3-propan-2-ylpyrazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;bis(2-methylpropylbenzene);2-propan-2-yloxane;1-(2-propan-2-yl-1,3-oxazol-4-yl)ethanone;4-propan-2-yl-1,3-thiazole (PubChem CID 157063479) has the molecular formula C187H306ClF3N12O7S4 and a molecular weight of 3055.30 g/mol. Its IUPAC name is 2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;1-chloro-4-propan-2-ylbenzene;cumene;2-cyclopropyl-5-propan-2-yl-1,3,4-thiadiazole;2,3-dimethylbutane;bis(1-fluoro-4-propan-2-ylbenzene);5-fluoro-2-propan-2-ylpyridine;methane;1-methyl-4-(2-methylpropyl)benzene;1-methyl-4-propan-2-ylbenzene;methyl 3-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;1-methyl-3-propan-2-ylpyrazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;bis(2-methylpropylbenzene);2-propan-2-yloxane;1-(2-propan-2-yl-1,3-oxazol-4-yl)ethanone;4-propan-2-yl-1,3-thiazole.

Molecular Properties

Compound Name2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;1-chloro-4-propan-2-ylbenzene;cumene;2-cyclopropyl-5-propan-2-yl-1,3,4-thiadiazole;2,3-dimethylbutane;bis(1-fluoro-4-propan-2-ylbenzene);5-fluoro-2-propan-2-ylpyridine;methane;1-methyl-4-(2-methylpropyl)benzene;1-methyl-4-propan-2-ylbenzene;methyl 3-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;1-methyl-3-propan-2-ylpyrazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;bis(2-methylpropylbenzene);2-propan-2-yloxane;1-(2-propan-2-yl-1,3-oxazol-4-yl)ethanone;4-propan-2-yl-1,3-thiazole
PubChem CID157063479
Molecular FormulaC187H306ClF3N12O7S4
Molecular Weight3055.30 g/mol
Exact Mass3052.25
IUPAC Name2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;1-chloro-4-propan-2-ylbenzene;cumene;2-cyclopropyl-5-propan-2-yl-1,3,4-thiadiazole;2,3-dimethylbutane;bis(1-fluoro-4-propan-2-ylbenzene);5-fluoro-2-propan-2-ylpyridine;methane;1-methyl-4-(2-methylpropyl)benzene;1-methyl-4-propan-2-ylbenzene;methyl 3-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;1-methyl-3-propan-2-ylpyrazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;bis(2-methylpropylbenzene);2-propan-2-yloxane;1-(2-propan-2-yl-1,3-oxazol-4-yl)ethanone;4-propan-2-yl-1,3-thiazole
SMILESC.C.C.C.C.C.C.C.C.C.C.C.C.CC(=O)c1coc(C(C)C)n1.CC(C)C(C)C.CC(C)C1CCCCO1.CC(C)Cc1ccccc1.CC(C)Cc1ccccc1.CC(C)c1ccc(Cl)cc1.CC(C)c1ccc(F)cc1.CC(C)c1ccc(F)cc1.CC(C)c1ccc(F)cn1.CC(C)c1ccccc1.CC(C)c1ccn(C)n1.CC(C)c1cscn1.CC(C)c1nnc(C(C)(C)C)s1.CC(C)c1nnc(C2CC2)s1.COC(=O)c1ccc(C(C)C)cc1.COC(=O)c1cccc(C(C)C)c1.Cc1ccc(C(C)C)cc1.Cc1ccc(CC(C)C)cc1.Cc1cccc(C(C)C)n1.Cc1nnc(C(C)C)s1
InChIInChI=1S/2C11H14O2.C11H16.3C10H14.C9H11Cl.2C9H11F.C9H16N2S.C9H13N.C9H12.C8H10FN.C8H12N2S.C8H11NO2.C8H16O.C7H12N2.C6H10N2S.C6H9NS.C6H14.13CH4/c1-8(2)9-4-6-10(7-5-9)11(12)13-3;1-8(2)9-5-4-6-10(7-9)11(12)13-3;1-9(2)8-11-6-4-10(3)5-7-11;1-8(2)10-6-4-9(3)5-7-10;2*1-9(2)8-10-6-4-3-5-7-10;3*1-7(2)8-3-5-9(10)6-4-8;1-6(2)7-10-11-8(12-7)9(3,4)5;1-7(2)9-6-4-5-8(3)10-9;1-8(2)9-6-4-3-5-7-9;1-6(2)8-4-3-7(9)5-10-8;1-5(2)7-9-10-8(11-7)6-3-4-6;1-5(2)8-9-7(4-11-8)6(3)10;1-7(2)8-5-3-4-6-9-8;1-6(2)7-4-5-9(3)8-7;1-4(2)6-8-7-5(3)9-6;1-5(2)6-3-8-4-7-6;1-5(2)6(3)4;;;;;;;;;;;;;/h2*4-8H,1-3H3;4-7,9H,8H2,1-3H3;4-8H,1-3H3;2*3-7,9H,8H2,1-2H3;3*3-7H,1-2H3;6H,1-5H3;4-7H,1-3H3;3-8H,1-2H3;3-6H,1-2H3;5-6H,3-4H2,1-2H3;4-5H,1-3H3;7-8H,3-6H2,1-2H3;4-6H,1-3H3;4H,1-3H3;3-5H,1-2H3;5-6H,1-4H3;13*1H4
InChIKeyABPFMRLVAYVLML-UHFFFAOYSA-N
XLogP60.36
TPSA238.76 Ų
H-Bond Donors
H-Bond Acceptors23
Rotatable Bonds27
Heavy Atoms214
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003055.30
LogP ≤ 560.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1023

Analyze 2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;1-chloro-4-propan-2-ylbenzene;cumene;2-cyclopropyl-5-propan-2-yl-1,3,4-thiadiazole;2,3-dimethylbutane;bis(1-fluoro-4-propan-2-ylbenzene);5-fluoro-2-propan-2-ylpyridine;methane;1-methyl-4-(2-methylpropyl)benzene;1-methyl-4-propan-2-ylbenzene;methyl 3-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;1-methyl-3-propan-2-ylpyrazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;bis(2-methylpropylbenzene);2-propan-2-yloxane;1-(2-propan-2-yl-1,3-oxazol-4-yl)ethanone;4-propan-2-yl-1,3-thiazole with MolForge

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Launch Full Analysis

Related Compounds

2-Tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;cumene;2-cyclopropyl-5-propan-2-yl-1,3,4-thiadiazole;2,3-dimethylbutane;5-fluoro-2-propan-2-ylpyridine;methane;1-methyl-4-(2-methylpropyl)benzene;methyl 3-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;1-methyl-3-propan-2-ylpyrazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;bis(2-methylpropylbenzene);2-propan-2-yloxane;1-(2-propan-2-yl-1,3-oxazol-4-yl)ethanone
CID 157249195
2-Tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;1-chloro-4-propan-2-ylbenzene;cumene;2-cyclopropyl-5-propan-2-yl-1,3,4-thiadiazole;2,3-dimethylbutane;1-fluoro-4-propan-2-ylbenzene;5-fluoro-2-propan-2-ylpyridine;methane;1-methyl-4-(2-methylpropyl)benzene;1-methyl-4-propan-2-ylbenzene;methyl 3-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;1-methyl-3-propan-2-ylpyrazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;bis(2-methylpropylbenzene);2-propan-2-yloxane;1-(2-propan-2-yl-1,3-oxazol-4-yl)ethanone;4-propan-2-yl-1,3-thiazole
CID 157850856
2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;5-chloro-2-propan-2-ylpyridine;2-cyclopropyl-5-propan-2-yl-1,3,4-thiadiazole;2,3-dimethylbutane;ethyl 2-propan-2-yl-1,3-oxazole-4-carboxylate;1-fluoro-4-propan-2-ylbenzene;5-fluoro-2-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyrimidine;2-methoxy-6-propan-2-ylpyridine;bis(1-methyl-4-(2-methylpropyl)benzene);methyl 3-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;1-methyl-3-propan-2-ylpyrazole;5-methyl-2-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;2-methylpropylbenzene;2-propan-2-yloxane;2-propan-2-ylpyridine;3-propan-2-ylpyridine;5-propan-2-yl-3H-pyrrole
CID 160701606
Cumene;1-fluoro-2-propan-2-ylbenzene;1-fluoro-3-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;2-methyl-5-propan-2-ylfuran;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;2-methyl-5-propan-2-yl-1,3-oxazole;3-methyl-1-propan-2-ylpyrazole;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-methyl-5-propan-2-ylthiophene;4-methyl-2-propan-2-yltriazole;propan-2-ylcyclohexane;2-propan-2-ylfuran;2-propan-2-yl-1,3,4-oxadiazole;2-propan-2-yl-1,3-oxazole;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-yltriazole
CID 160934943
2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;1-chloro-4-propan-2-ylbenzene;cumene;2-cyclopropyl-5-propan-2-yl-1,3,4-thiadiazole;2,3-dimethylbutane;2-ethyl-6-propan-2-ylpyridine;ethyl 2-propan-2-yl-3H-pyrrole-5-carboxylate;bis(1-fluoro-4-propan-2-ylbenzene);5-fluoro-2-propan-2-ylpyridine;methane;1-(1-methoxyethenyl)-3-propan-2-ylbenzene;bis(1-methyl-4-(2-methylpropyl)benzene);1-methyl-4-propan-2-ylbenzene;1-methyl-3-propan-2-ylpyrazole;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;2-methylpropylbenzene;propan-2-ylcyclohexane;1-(4-propan-2-ylphenyl)propan-1-one;5-propan-2-yl-3H-pyrrole
CID 161032644

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;1-chloro-4-propan-2-ylbenzene;cumene;2-cyclopropyl-5-propan-2-yl-1,3,4-thiadiazole;2,3-dimethylbutane;bis(1-fluoro-4-propan-2-ylbenzene);5-fluoro-2-propan-2-ylpyridine;methane;1-methyl-4-(2-methylpropyl)benzene;1-methyl-4-propan-2-ylbenzene;methyl 3-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;1-methyl-3-propan-2-ylpyrazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;bis(2-methylpropylbenzene);2-propan-2-yloxane;1-(2-propan-2-yl-1,3-oxazol-4-yl)ethanone;4-propan-2-yl-1,3-thiazole?
The IUPAC name of 2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;1-chloro-4-propan-2-ylbenzene;cumene;2-cyclopropyl-5-propan-2-yl-1,3,4-thiadiazole;2,3-dimethylbutane;bis(1-fluoro-4-propan-2-ylbenzene);5-fluoro-2-propan-2-ylpyridine;methane;1-methyl-4-(2-methylpropyl)benzene;1-methyl-4-propan-2-ylbenzene;methyl 3-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;1-methyl-3-propan-2-ylpyrazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;bis(2-methylpropylbenzene);2-propan-2-yloxane;1-(2-propan-2-yl-1,3-oxazol-4-yl)ethanone;4-propan-2-yl-1,3-thiazole (CID 157063479) is 2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;1-chloro-4-propan-2-ylbenzene;cumene;2-cyclopropyl-5-propan-2-yl-1,3,4-thiadiazole;2,3-dimethylbutane;bis(1-fluoro-4-propan-2-ylbenzene);5-fluoro-2-propan-2-ylpyridine;methane;1-methyl-4-(2-methylpropyl)benzene;1-methyl-4-propan-2-ylbenzene;methyl 3-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;1-methyl-3-propan-2-ylpyrazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;bis(2-methylpropylbenzene);2-propan-2-yloxane;1-(2-propan-2-yl-1,3-oxazol-4-yl)ethanone;4-propan-2-yl-1,3-thiazole.
What is the SMILES notation for 2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;1-chloro-4-propan-2-ylbenzene;cumene;2-cyclopropyl-5-propan-2-yl-1,3,4-thiadiazole;2,3-dimethylbutane;bis(1-fluoro-4-propan-2-ylbenzene);5-fluoro-2-propan-2-ylpyridine;methane;1-methyl-4-(2-methylpropyl)benzene;1-methyl-4-propan-2-ylbenzene;methyl 3-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;1-methyl-3-propan-2-ylpyrazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;bis(2-methylpropylbenzene);2-propan-2-yloxane;1-(2-propan-2-yl-1,3-oxazol-4-yl)ethanone;4-propan-2-yl-1,3-thiazole?
The canonical SMILES for 2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;1-chloro-4-propan-2-ylbenzene;cumene;2-cyclopropyl-5-propan-2-yl-1,3,4-thiadiazole;2,3-dimethylbutane;bis(1-fluoro-4-propan-2-ylbenzene);5-fluoro-2-propan-2-ylpyridine;methane;1-methyl-4-(2-methylpropyl)benzene;1-methyl-4-propan-2-ylbenzene;methyl 3-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;1-methyl-3-propan-2-ylpyrazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;bis(2-methylpropylbenzene);2-propan-2-yloxane;1-(2-propan-2-yl-1,3-oxazol-4-yl)ethanone;4-propan-2-yl-1,3-thiazole is C.C.C.C.C.C.C.C.C.C.C.C.C.CC(=O)c1coc(C(C)C)n1.CC(C)C(C)C.CC(C)C1CCCCO1.CC(C)Cc1ccccc1.CC(C)Cc1ccccc1.CC(C)c1ccc(Cl)cc1.CC(C)c1ccc(F)cc1.CC(C)c1ccc(F)cc1.CC(C)c1ccc(F)cn1.CC(C)c1ccccc1.CC(C)c1ccn(C)n1.CC(C)c1cscn1.CC(C)c1nnc(C(C)(C)C)s1.CC(C)c1nnc(C2CC2)s1.COC(=O)c1ccc(C(C)C)cc1.COC(=O)c1cccc(C(C)C)c1.Cc1ccc(C(C)C)cc1.Cc1ccc(CC(C)C)cc1.Cc1cccc(C(C)C)n1.Cc1nnc(C(C)C)s1.
What is the InChIKey of 2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;1-chloro-4-propan-2-ylbenzene;cumene;2-cyclopropyl-5-propan-2-yl-1,3,4-thiadiazole;2,3-dimethylbutane;bis(1-fluoro-4-propan-2-ylbenzene);5-fluoro-2-propan-2-ylpyridine;methane;1-methyl-4-(2-methylpropyl)benzene;1-methyl-4-propan-2-ylbenzene;methyl 3-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;1-methyl-3-propan-2-ylpyrazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;bis(2-methylpropylbenzene);2-propan-2-yloxane;1-(2-propan-2-yl-1,3-oxazol-4-yl)ethanone;4-propan-2-yl-1,3-thiazole?
The InChIKey is ABPFMRLVAYVLML-UHFFFAOYSA-N. The full InChI is InChI=1S/2C11H14O2.C11H16.3C10H14.C9H11Cl.2C9H11F.C9H16N2S.C9H13N.C9H12.C8H10FN.C8H12N2S.C8H11NO2.C8H16O.C7H12N2.C6H10N2S.C6H9NS.C6H14.13CH4/c1-8(2)9-4-6-10(7-5-9)11(12)13-3;1-8(2)9-5-4-6-10(7-9)11(12)13-3;1-9(2)8-11-6-4-10(3)5-7-11;1-8(2)10-6-4-9(3)5-7-10;2*1-9(2)8-10-6-4-3-5-7-10;3*1-7(2)8-3-5-9(10)6-4-8;1-6(2)7-10-11-8(12-7)9(3,4)5;1-7(2)9-6-4-5-8(3)10-9;1-8(2)9-6-4-3-5-7-9;1-6(2)8-4-3-7(9)5-10-8;1-5(2)7-9-10-8(11-7)6-3-4-6;1-5(2)8-9-7(4-11-8)6(3)10;1-7(2)8-5-3-4-6-9-8;1-6(2)7-4-5-9(3)8-7;1-4(2)6-8-7-5(3)9-6;1-5(2)6-3-8-4-7-6;1-5(2)6(3)4;;;;;;;;;;;;;/h2*4-8H,1-3H3;4-7,9H,8H2,1-3H3;4-8H,1-3H3;2*3-7,9H,8H2,1-2H3;3*3-7H,1-2H3;6H,1-5H3;4-7H,1-3H3;3-8H,1-2H3;3-6H,1-2H3;5-6H,3-4H2,1-2H3;4-5H,1-3H3;7-8H,3-6H2,1-2H3;4-6H,1-3H3;4H,1-3H3;3-5H,1-2H3;5-6H,1-4H3;13*1H4.
What are the key properties of 2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;1-chloro-4-propan-2-ylbenzene;cumene;2-cyclopropyl-5-propan-2-yl-1,3,4-thiadiazole;2,3-dimethylbutane;bis(1-fluoro-4-propan-2-ylbenzene);5-fluoro-2-propan-2-ylpyridine;methane;1-methyl-4-(2-methylpropyl)benzene;1-methyl-4-propan-2-ylbenzene;methyl 3-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;1-methyl-3-propan-2-ylpyrazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;bis(2-methylpropylbenzene);2-propan-2-yloxane;1-(2-propan-2-yl-1,3-oxazol-4-yl)ethanone;4-propan-2-yl-1,3-thiazole?
2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;1-chloro-4-propan-2-ylbenzene;cumene;2-cyclopropyl-5-propan-2-yl-1,3,4-thiadiazole;2,3-dimethylbutane;bis(1-fluoro-4-propan-2-ylbenzene);5-fluoro-2-propan-2-ylpyridine;methane;1-methyl-4-(2-methylpropyl)benzene;1-methyl-4-propan-2-ylbenzene;methyl 3-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;1-methyl-3-propan-2-ylpyrazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;bis(2-methylpropylbenzene);2-propan-2-yloxane;1-(2-propan-2-yl-1,3-oxazol-4-yl)ethanone;4-propan-2-yl-1,3-thiazole has a molecular weight of 3055.30 g/mol, XLogP of 60.36, 27 rotatable bonds, 0 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;1-chloro-4-propan-2-ylbenzene;cumene;2-cyclopropyl-5-propan-2-yl-1,3,4-thiadiazole;2,3-dimethylbutane;bis(1-fluoro-4-propan-2-ylbenzene);5-fluoro-2-propan-2-ylpyridine;methane;1-methyl-4-(2-methylpropyl)benzene;1-methyl-4-propan-2-ylbenzene;methyl 3-propan-2-ylbenzoate;methyl 4-propan-2-ylbenzoate;1-methyl-3-propan-2-ylpyrazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;bis(2-methylpropylbenzene);2-propan-2-yloxane;1-(2-propan-2-yl-1,3-oxazol-4-yl)ethanone;4-propan-2-yl-1,3-thiazole is sourced from PubChem (CID 157063479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).