5-tert-butyl-1,3-benzothiazol-2-amine;4-tert-butyl-2-fluoroaniline;4-tert-butyl-3-fluorophenol;5-tert-butyl-1H-indazole;5-tert-butyl-3-methyl-2H-indazole;4-tert-butyl-5-methyl-1H-pyrazole;4-tert-butyl-1-methyl-3-(trifluoromethyl)pyrazole;4-tert-butylphenol;3-tert-butyl-1H-pyrrolo[3,2-b]pyridine;4-tert-butyl-5-(trifluoromethyl)-1H-pyrazole;2,2-dimethyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]propanamide

C118H163F11N18O3S — CID 157150047

IUPAC5-tert-butyl-1,3-benzothiazol-2-amine;4-tert-butyl-2-fluoroaniline;4-tert-butyl-3-fluorophenol;5-tert-butyl-1H-indazole;5-tert-butyl-3-methyl-2H-indazole;4-tert-butyl-5-methyl-1H-pyrazole;4-tert-butyl-1-methyl-3-(trifluoromethyl)pyrazole;4-tert-butylphenol;3-tert-butyl-1H-pyrrolo[3,2-b]pyridine;4-tert-butyl-5-(trifluoromethyl)-1H-pyrazole;2,2-dimethyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]propanamide
SMILESCC(C)(C)c1c[nH]c2cccnc12.CC(C)(C)c1ccc(N)c(F)c1.CC(C)(C)c1ccc(O)cc1.CC(C)(C)c1ccc(O)cc1F.CC(C)(C)c1ccc2[nH]ncc2c1.CC(C)(C)c1ccc2sc(N)nc2c1.CC(C)(C)c1cn[nH]c1C(F)(F)F.CN1CCN(Cc2ccc(NC(=O)C(C)(C)C)cc2C(F)(F)F)CC1.Cc1[nH]nc2ccc(C(C)(C)C)cc12.Cc1[nH]ncc1C(C)(C)C.Cn1cc(C(C)(C)C)c(C(F)(F)F)n1
InChIInChI=1S/C18H26F3N3O.C12H16N2.C11H14N2S.2C11H14N2.C10H14FN.C10H13FO.C10H14O.C9H13F3N2.C8H11F3N2.C8H14N2/c1-17(2,3)16(25)22-14-6-5-13(15(11-14)18(19,20)21)12-24-9-7-23(4)8-10-24;1-8-10-7-9(12(2,3)4)5-6-11(10)14-13-8;1-11(2,3)7-4-5-9-8(6-7)13-10(12)14-9;1-11(2,3)9-4-5-10-8(6-9)7-12-13-10;1-11(2,3)8-7-13-9-5-4-6-12-10(8)9;1-10(2,3)7-4-5-9(12)8(11)6-7;1-10(2,3)8-5-4-7(12)6-9(8)11;1-10(2,3)8-4-6-9(11)7-5-8;1-8(2,3)6-5-14(4)13-7(6)9(10,11)12;1-7(2,3)5-4-12-13-6(5)8(9,10)11;1-6-7(5-9-10-6)8(2,3)4/h5-6,11H,7-10,12H2,1-4H3,(H,22,25);5-7H,1-4H3,(H,13,14);4-6H,1-3H3,(H2,12,13);4-7H,1-3H3,(H,12,13);4-7,13H,1-3H3;4-6H,12H2,1-3H3;4-6,12H,1-3H3;4-7,11H,1-3H3;5H,1-4H3;4H,1-3H3,(H,12,13);5H,1-4H3,(H,9,10)
InChIKeyALDPIGZFOMMUJO-UHFFFAOYSA-N
MW2122.77 g/mol
LogP31.20
Rot. Bonds3

About 5-tert-butyl-1,3-benzothiazol-2-amine;4-tert-butyl-2-fluoroaniline;4-tert-butyl-3-fluorophenol;5-tert-butyl-1H-indazole;5-tert-butyl-3-methyl-2H-indazole;4-tert-butyl-5-methyl-1H-pyrazole;4-tert-butyl-1-methyl-3-(trifluoromethyl)pyrazole;4-tert-butylphenol;3-tert-butyl-1H-pyrrolo[3,2-b]pyridine;4-tert-butyl-5-(trifluoromethyl)-1H-pyrazole;2,2-dimethyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]propanamide

5-tert-butyl-1,3-benzothiazol-2-amine;4-tert-butyl-2-fluoroaniline;4-tert-butyl-3-fluorophenol;5-tert-butyl-1H-indazole;5-tert-butyl-3-methyl-2H-indazole;4-tert-butyl-5-methyl-1H-pyrazole;4-tert-butyl-1-methyl-3-(trifluoromethyl)pyrazole;4-tert-butylphenol;3-tert-butyl-1H-pyrrolo[3,2-b]pyridine;4-tert-butyl-5-(trifluoromethyl)-1H-pyrazole;2,2-dimethyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]propanamide (PubChem CID 157150047) has the molecular formula C118H163F11N18O3S and a molecular weight of 2122.77 g/mol. Its IUPAC name is 5-tert-butyl-1,3-benzothiazol-2-amine;4-tert-butyl-2-fluoroaniline;4-tert-butyl-3-fluorophenol;5-tert-butyl-1H-indazole;5-tert-butyl-3-methyl-2H-indazole;4-tert-butyl-5-methyl-1H-pyrazole;4-tert-butyl-1-methyl-3-(trifluoromethyl)pyrazole;4-tert-butylphenol;3-tert-butyl-1H-pyrrolo[3,2-b]pyridine;4-tert-butyl-5-(trifluoromethyl)-1H-pyrazole;2,2-dimethyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]propanamide.

Molecular Properties

Compound Name5-tert-butyl-1,3-benzothiazol-2-amine;4-tert-butyl-2-fluoroaniline;4-tert-butyl-3-fluorophenol;5-tert-butyl-1H-indazole;5-tert-butyl-3-methyl-2H-indazole;4-tert-butyl-5-methyl-1H-pyrazole;4-tert-butyl-1-methyl-3-(trifluoromethyl)pyrazole;4-tert-butylphenol;3-tert-butyl-1H-pyrrolo[3,2-b]pyridine;4-tert-butyl-5-(trifluoromethyl)-1H-pyrazole;2,2-dimethyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]propanamide
PubChem CID157150047
Molecular FormulaC118H163F11N18O3S
Molecular Weight2122.77 g/mol
Exact Mass2121.27
IUPAC Name5-tert-butyl-1,3-benzothiazol-2-amine;4-tert-butyl-2-fluoroaniline;4-tert-butyl-3-fluorophenol;5-tert-butyl-1H-indazole;5-tert-butyl-3-methyl-2H-indazole;4-tert-butyl-5-methyl-1H-pyrazole;4-tert-butyl-1-methyl-3-(trifluoromethyl)pyrazole;4-tert-butylphenol;3-tert-butyl-1H-pyrrolo[3,2-b]pyridine;4-tert-butyl-5-(trifluoromethyl)-1H-pyrazole;2,2-dimethyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]propanamide
SMILESCC(C)(C)c1c[nH]c2cccnc12.CC(C)(C)c1ccc(N)c(F)c1.CC(C)(C)c1ccc(O)cc1.CC(C)(C)c1ccc(O)cc1F.CC(C)(C)c1ccc2[nH]ncc2c1.CC(C)(C)c1ccc2sc(N)nc2c1.CC(C)(C)c1cn[nH]c1C(F)(F)F.CN1CCN(Cc2ccc(NC(=O)C(C)(C)C)cc2C(F)(F)F)CC1.Cc1[nH]nc2ccc(C(C)(C)C)cc12.Cc1[nH]ncc1C(C)(C)C.Cn1cc(C(C)(C)C)c(C(F)(F)F)n1
InChIInChI=1S/C18H26F3N3O.C12H16N2.C11H14N2S.2C11H14N2.C10H14FN.C10H13FO.C10H14O.C9H13F3N2.C8H11F3N2.C8H14N2/c1-17(2,3)16(25)22-14-6-5-13(15(11-14)18(19,20)21)12-24-9-7-23(4)8-10-24;1-8-10-7-9(12(2,3)4)5-6-11(10)14-13-8;1-11(2,3)7-4-5-9-8(6-7)13-10(12)14-9;1-11(2,3)9-4-5-10-8(6-9)7-12-13-10;1-11(2,3)8-7-13-9-5-4-6-12-10(8)9;1-10(2,3)7-4-5-9(12)8(11)6-7;1-10(2,3)8-5-4-7(12)6-9(8)11;1-10(2,3)8-4-6-9(11)7-5-8;1-8(2,3)6-5-14(4)13-7(6)9(10,11)12;1-7(2,3)5-4-12-13-6(5)8(9,10)11;1-6-7(5-9-10-6)8(2,3)4/h5-6,11H,7-10,12H2,1-4H3,(H,22,25);5-7H,1-4H3,(H,13,14);4-6H,1-3H3,(H2,12,13);4-7H,1-3H3,(H,12,13);4-7,13H,1-3H3;4-6H,12H2,1-3H3;4-6,12H,1-3H3;4-7,11H,1-3H3;5H,1-4H3;4H,1-3H3,(H,12,13);5H,1-4H3,(H,9,10)
InChIKeyALDPIGZFOMMUJO-UHFFFAOYSA-N
XLogP31.20
TPSA302.19 Ų
H-Bond Donors10
H-Bond Acceptors16
Rotatable Bonds3
Heavy Atoms151
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002122.77
LogP ≤ 531.20
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1016

Computed Properties (RDKit)

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

Analyze 5-tert-butyl-1,3-benzothiazol-2-amine;4-tert-butyl-2-fluoroaniline;4-tert-butyl-3-fluorophenol;5-tert-butyl-1H-indazole;5-tert-butyl-3-methyl-2H-indazole;4-tert-butyl-5-methyl-1H-pyrazole;4-tert-butyl-1-methyl-3-(trifluoromethyl)pyrazole;4-tert-butylphenol;3-tert-butyl-1H-pyrrolo[3,2-b]pyridine;4-tert-butyl-5-(trifluoromethyl)-1H-pyrazole;2,2-dimethyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]propanamide with MolForge

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Related Compounds

5-tert-butyl-1,3-benzothiazol-2-amine;4-tert-butyl-1,3-dimethylpyrazole;4-tert-butyl-2-fluoroaniline;4-tert-butyl-3-fluorophenol;5-tert-butyl-1H-indazole;5-tert-butyl-3-methyl-2H-indazole;bis(4-tert-butyl-5-methyl-1H-pyrazole);4-tert-butylphenol;3-tert-butyl-1H-pyrrolo[3,2-b]pyridine;2,2-dimethyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]propanamide
CID 158975370
5-tert-butyl-1,3-benzothiazol-2-amine;4-tert-butyl-1,3-dimethylpyrazole;4-tert-butyl-2-fluoroaniline;4-tert-butyl-3-fluorophenol;(3-tert-butyl-2-fluorophenyl)boronic acid;5-tert-butyl-1H-indazole;5-tert-butyl-3-methyl-2H-indazole;bis(4-tert-butyl-5-methyl-1H-pyrazole);4-tert-butylphenol;3-tert-butyl-1H-pyrrolo[3,2-b]pyridine;2,2-dimethyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]propanamide
CID 160351966
5-tert-butyl-1,3-benzothiazol-2-amine;4-tert-butyl-1,3-dimethylpyrazole;4-tert-butyl-2-fluoroaniline;1-tert-butyl-2-fluoro-4-methylbenzene;(3-tert-butyl-2-fluorophenyl)boronic acid;5-tert-butyl-1H-indazole;1-tert-butyl-4-methylbenzene;5-tert-butyl-3-methyl-1H-isoindole;4-tert-butyl-5-methyl-1H-pyrazole;4-tert-butyl-5-methyl-2H-pyrrole;3-tert-butyl-1H-pyrrolo[3,2-b]pyridine;2,2-dimethyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]propanamide
CID 161036356
5-tert-butyl-1,3-benzothiazol-2-amine;4-tert-butyl-2-fluoroaniline;4-tert-butyl-3-fluorophenol;5-tert-butyl-1H-indazole;1-tert-butyl-4-methylbenzene;5-tert-butyl-3-methyl-1H-isoindole;bis(4-tert-butyl-5-methyl-2H-pyrrole);4-tert-butyl-1-methyl-3-(trifluoromethyl)pyrazole;3-tert-butyl-1H-pyrrolo[3,2-b]pyridine;2,2-dimethyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]propanamide
CID 163462355
CID 163817141
CID 163817141
tert-butylbenzene;5-tert-butyl-1,3-benzothiazol-2-amine;tert-butylcyclohexane;N-tert-butylcyclopropanamine;tert-butylcyclopropane;1-tert-butyl-3-cyclopropylurea;4-tert-butyl-1,3-dimethylpyrazole;1-tert-butyl-2-fluoro-3-methylbenzene;4-tert-butyl-2-fluoro-1-methylbenzene;4-tert-butyl-3-fluorophenol;5-tert-butyl-1H-isoindole;1-tert-butyl-4-methylbenzene;5-tert-butyl-3-methyl-1H-isoindole;1-tert-butyl-4-methylpiperazine;bis(4-tert-butyl-5-methyl-2H-pyrrole);1-tert-butylpiperidine;2-tert-butylpyridine;3-tert-butyl-1H-pyrrolo[3,2-b]pyridine;1-cyclopropyl-3-(2,2-dimethylpropyl)urea;3,3-dimethylbutan-2-one;3,3-dimethylbut-1-yne;2,2-dimethyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]propanamide;2,2-dimethyl-1-piperidin-1-ylpropan-1-one;N-(2,2-dimethylpropyl)cyclopropanecarboxamide;1-(2,2-dimethylpropyl)-3-fluorobenzene
CID 163870170
5-tert-butyl-1,3-benzothiazol-2-amine;4-tert-butyl-2-fluoroaniline;1-tert-butyl-2-fluoro-3-methylbenzene;4-tert-butyl-3-fluorophenol;5-tert-butyl-1H-indazole;1-tert-butyl-4-methylbenzene;5-tert-butyl-3-methyl-1H-isoindole;bis(4-tert-butyl-5-methyl-2H-pyrrole);4-tert-butyl-1-methyl-3-(trifluoromethyl)pyrazole;3-tert-butyl-1H-pyrrolo[3,2-b]pyridine;2,2-dimethyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]propanamide
CID 164173166
2-[[4-[[2-(5-amino-3a,7a-dihydro-1H-indazol-4-yl)cyclohexen-1-yl]methyl]cyclohexa-2,4-dien-1-yl]-propylamino]ethanol;5-[C-(cyclohexen-1-yl)-N-(1H-indazol-5-yl)carbonimidoyl]-1,3-benzothiazol-2-amine;N-[4-[5-(5-ethenyl-1H-pyrazol-4-yl)-2-(4-hydroxyphenyl)-4-pyridinyl]butan-2-yl]acetamide;(3E,5E)-6-(5-oxa-9,14,15-triazatetracyclo[8.7.0.02,7.013,17]heptadeca-1(10),2(7),8,11,13(17),15-hexaen-8-yl)hexa-1,3,5-trien-3-ol;4-(6,7,8,9-tetrahydro-1H-pyrazolo[5,4-c]phenanthridin-5-yl)cyclohexa-1,3-dien-1-ol
CID 159233947
3-fluoro-4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)phenol;7-(1H-indazol-5-yl)-8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridine;7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridine;bis(6-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)-1,3-benzothiazol-2-amine)
CID 163926760

Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-1,3-benzothiazol-2-amine;4-tert-butyl-2-fluoroaniline;4-tert-butyl-3-fluorophenol;5-tert-butyl-1H-indazole;5-tert-butyl-3-methyl-2H-indazole;4-tert-butyl-5-methyl-1H-pyrazole;4-tert-butyl-1-methyl-3-(trifluoromethyl)pyrazole;4-tert-butylphenol;3-tert-butyl-1H-pyrrolo[3,2-b]pyridine;4-tert-butyl-5-(trifluoromethyl)-1H-pyrazole;2,2-dimethyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]propanamide?
The IUPAC name of 5-tert-butyl-1,3-benzothiazol-2-amine;4-tert-butyl-2-fluoroaniline;4-tert-butyl-3-fluorophenol;5-tert-butyl-1H-indazole;5-tert-butyl-3-methyl-2H-indazole;4-tert-butyl-5-methyl-1H-pyrazole;4-tert-butyl-1-methyl-3-(trifluoromethyl)pyrazole;4-tert-butylphenol;3-tert-butyl-1H-pyrrolo[3,2-b]pyridine;4-tert-butyl-5-(trifluoromethyl)-1H-pyrazole;2,2-dimethyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]propanamide (CID 157150047) is 5-tert-butyl-1,3-benzothiazol-2-amine;4-tert-butyl-2-fluoroaniline;4-tert-butyl-3-fluorophenol;5-tert-butyl-1H-indazole;5-tert-butyl-3-methyl-2H-indazole;4-tert-butyl-5-methyl-1H-pyrazole;4-tert-butyl-1-methyl-3-(trifluoromethyl)pyrazole;4-tert-butylphenol;3-tert-butyl-1H-pyrrolo[3,2-b]pyridine;4-tert-butyl-5-(trifluoromethyl)-1H-pyrazole;2,2-dimethyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]propanamide.
What is the SMILES notation for 5-tert-butyl-1,3-benzothiazol-2-amine;4-tert-butyl-2-fluoroaniline;4-tert-butyl-3-fluorophenol;5-tert-butyl-1H-indazole;5-tert-butyl-3-methyl-2H-indazole;4-tert-butyl-5-methyl-1H-pyrazole;4-tert-butyl-1-methyl-3-(trifluoromethyl)pyrazole;4-tert-butylphenol;3-tert-butyl-1H-pyrrolo[3,2-b]pyridine;4-tert-butyl-5-(trifluoromethyl)-1H-pyrazole;2,2-dimethyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]propanamide?
The canonical SMILES for 5-tert-butyl-1,3-benzothiazol-2-amine;4-tert-butyl-2-fluoroaniline;4-tert-butyl-3-fluorophenol;5-tert-butyl-1H-indazole;5-tert-butyl-3-methyl-2H-indazole;4-tert-butyl-5-methyl-1H-pyrazole;4-tert-butyl-1-methyl-3-(trifluoromethyl)pyrazole;4-tert-butylphenol;3-tert-butyl-1H-pyrrolo[3,2-b]pyridine;4-tert-butyl-5-(trifluoromethyl)-1H-pyrazole;2,2-dimethyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]propanamide is CC(C)(C)c1c[nH]c2cccnc12.CC(C)(C)c1ccc(N)c(F)c1.CC(C)(C)c1ccc(O)cc1.CC(C)(C)c1ccc(O)cc1F.CC(C)(C)c1ccc2[nH]ncc2c1.CC(C)(C)c1ccc2sc(N)nc2c1.CC(C)(C)c1cn[nH]c1C(F)(F)F.CN1CCN(Cc2ccc(NC(=O)C(C)(C)C)cc2C(F)(F)F)CC1.Cc1[nH]nc2ccc(C(C)(C)C)cc12.Cc1[nH]ncc1C(C)(C)C.Cn1cc(C(C)(C)C)c(C(F)(F)F)n1.
What is the InChIKey of 5-tert-butyl-1,3-benzothiazol-2-amine;4-tert-butyl-2-fluoroaniline;4-tert-butyl-3-fluorophenol;5-tert-butyl-1H-indazole;5-tert-butyl-3-methyl-2H-indazole;4-tert-butyl-5-methyl-1H-pyrazole;4-tert-butyl-1-methyl-3-(trifluoromethyl)pyrazole;4-tert-butylphenol;3-tert-butyl-1H-pyrrolo[3,2-b]pyridine;4-tert-butyl-5-(trifluoromethyl)-1H-pyrazole;2,2-dimethyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]propanamide?
The InChIKey is ALDPIGZFOMMUJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26F3N3O.C12H16N2.C11H14N2S.2C11H14N2.C10H14FN.C10H13FO.C10H14O.C9H13F3N2.C8H11F3N2.C8H14N2/c1-17(2,3)16(25)22-14-6-5-13(15(11-14)18(19,20)21)12-24-9-7-23(4)8-10-24;1-8-10-7-9(12(2,3)4)5-6-11(10)14-13-8;1-11(2,3)7-4-5-9-8(6-7)13-10(12)14-9;1-11(2,3)9-4-5-10-8(6-9)7-12-13-10;1-11(2,3)8-7-13-9-5-4-6-12-10(8)9;1-10(2,3)7-4-5-9(12)8(11)6-7;1-10(2,3)8-5-4-7(12)6-9(8)11;1-10(2,3)8-4-6-9(11)7-5-8;1-8(2,3)6-5-14(4)13-7(6)9(10,11)12;1-7(2,3)5-4-12-13-6(5)8(9,10)11;1-6-7(5-9-10-6)8(2,3)4/h5-6,11H,7-10,12H2,1-4H3,(H,22,25);5-7H,1-4H3,(H,13,14);4-6H,1-3H3,(H2,12,13);4-7H,1-3H3,(H,12,13);4-7,13H,1-3H3;4-6H,12H2,1-3H3;4-6,12H,1-3H3;4-7,11H,1-3H3;5H,1-4H3;4H,1-3H3,(H,12,13);5H,1-4H3,(H,9,10).
What are the key properties of 5-tert-butyl-1,3-benzothiazol-2-amine;4-tert-butyl-2-fluoroaniline;4-tert-butyl-3-fluorophenol;5-tert-butyl-1H-indazole;5-tert-butyl-3-methyl-2H-indazole;4-tert-butyl-5-methyl-1H-pyrazole;4-tert-butyl-1-methyl-3-(trifluoromethyl)pyrazole;4-tert-butylphenol;3-tert-butyl-1H-pyrrolo[3,2-b]pyridine;4-tert-butyl-5-(trifluoromethyl)-1H-pyrazole;2,2-dimethyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]propanamide?
5-tert-butyl-1,3-benzothiazol-2-amine;4-tert-butyl-2-fluoroaniline;4-tert-butyl-3-fluorophenol;5-tert-butyl-1H-indazole;5-tert-butyl-3-methyl-2H-indazole;4-tert-butyl-5-methyl-1H-pyrazole;4-tert-butyl-1-methyl-3-(trifluoromethyl)pyrazole;4-tert-butylphenol;3-tert-butyl-1H-pyrrolo[3,2-b]pyridine;4-tert-butyl-5-(trifluoromethyl)-1H-pyrazole;2,2-dimethyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]propanamide has a molecular weight of 2122.77 g/mol, XLogP of 31.20, 3 rotatable bonds, 10 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-1,3-benzothiazol-2-amine;4-tert-butyl-2-fluoroaniline;4-tert-butyl-3-fluorophenol;5-tert-butyl-1H-indazole;5-tert-butyl-3-methyl-2H-indazole;4-tert-butyl-5-methyl-1H-pyrazole;4-tert-butyl-1-methyl-3-(trifluoromethyl)pyrazole;4-tert-butylphenol;3-tert-butyl-1H-pyrrolo[3,2-b]pyridine;4-tert-butyl-5-(trifluoromethyl)-1H-pyrazole;2,2-dimethyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]propanamide is sourced from PubChem (CID 157150047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).