[4-(1,3-benzothiazol-4-yl)phenyl]-trimethylsilane;4-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-N,N-dimethyl-1,3-benzoxazol-2-amine;4-(9,9-dimethylfluoren-2-yl)-1,3-benzothiazole;4-[4-(1,1,1,3,3,3-hexafluoropropan-2-yl)phenyl]-1,3-benzothiazole;4-(2-methylphenyl)-1,3-benzothiazole;4-(3-methylphenyl)-1,3-benzothiazole;4-(4-methylphenyl)-1,3-benzothiazole;4-naphthalen-1-yl-1,3-benzothiazole;4-phenyl-1,3-benzothiazole;4-(4-phenylphenyl)-1,3-benzothiazole;4-[2-(trifluoromethyl)phenyl]-1,3-benzothiazole;4-[4-(trifluoromethyl)phenyl]-1,3-benzothiazole

C196H147F12N13OS11Si2 — CID 158177825

IUPAC[4-(1,3-benzothiazol-4-yl)phenyl]-trimethylsilane;4-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-N,N-dimethyl-1,3-benzoxazol-2-amine;4-(9,9-dimethylfluoren-2-yl)-1,3-benzothiazole;4-[4-(1,1,1,3,3,3-hexafluoropropan-2-yl)phenyl]-1,3-benzothiazole;4-(2-methylphenyl)-1,3-benzothiazole;4-(3-methylphenyl)-1,3-benzothiazole;4-(4-methylphenyl)-1,3-benzothiazole;4-naphthalen-1-yl-1,3-benzothiazole;4-phenyl-1,3-benzothiazole;4-(4-phenylphenyl)-1,3-benzothiazole;4-[2-(trifluoromethyl)phenyl]-1,3-benzothiazole;4-[4-(trifluoromethyl)phenyl]-1,3-benzothiazole
SMILESCC1(C)c2ccccc2-c2ccc(-c3cccc4scnc34)cc21.CN(C)c1nc2c(-c3ccc4c(c3)[Si](C)(C)c3ccccc3-4)cccc2o1.C[Si](C)(C)c1ccc(-c2cccc3scnc23)cc1.Cc1ccc(-c2cccc3scnc23)cc1.Cc1cccc(-c2cccc3scnc23)c1.Cc1ccccc1-c1cccc2scnc12.FC(F)(F)C(c1ccc(-c2cccc3scnc23)cc1)C(F)(F)F.FC(F)(F)c1ccc(-c2cccc3scnc23)cc1.FC(F)(F)c1ccccc1-c1cccc2scnc12.c1ccc(-c2ccc(-c3cccc4scnc34)cc2)cc1.c1ccc(-c2cccc3scnc23)cc1.c1ccc2c(-c3cccc4scnc34)cccc2c1
InChIInChI=1S/C23H22N2OSi.C22H17NS.C19H13NS.C17H11NS.C16H9F6NS.C16H17NSSi.2C14H8F3NS.3C14H11NS.C13H9NS/c1-25(2)23-24-22-16(9-7-10-19(22)26-23)15-12-13-18-17-8-5-6-11-20(17)27(3,4)21(18)14-15;1-22(2)18-8-4-3-6-16(18)17-11-10-14(12-19(17)22)15-7-5-9-20-21(15)23-13-24-20;1-2-5-14(6-3-1)15-9-11-16(12-10-15)17-7-4-8-18-19(17)20-13-21-18;1-2-7-13-12(5-1)6-3-8-14(13)15-9-4-10-16-17(15)18-11-19-16;17-15(18,19)14(16(20,21)22)10-6-4-9(5-7-10)11-2-1-3-12-13(11)23-8-24-12;1-19(2,3)13-9-7-12(8-10-13)14-5-4-6-15-16(14)17-11-18-15;15-14(16,17)11-6-2-1-4-9(11)10-5-3-7-12-13(10)18-8-19-12;15-14(16,17)10-6-4-9(5-7-10)11-2-1-3-12-13(11)18-8-19-12;1-10-4-2-5-11(8-10)12-6-3-7-13-14(12)15-9-16-13;1-10-5-2-3-6-11(10)12-7-4-8-13-14(12)15-9-16-13;1-10-5-7-11(8-6-10)12-3-2-4-13-14(12)15-9-16-13;1-2-5-10(6-3-1)11-7-4-8-12-13(11)14-9-15-12/h5-14H,1-4H3;3-13H,1-2H3;1-13H;1-11H;1-8,14H;4-11H,1-3H3;2*1-8H;3*2-9H,1H3;1-9H
InChIKeyFYFDTCPSYQEWQR-UHFFFAOYSA-N
MW3337.31 g/mol
LogP58.80
Rot. Bonds16

About [4-(1,3-benzothiazol-4-yl)phenyl]-trimethylsilane;4-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-N,N-dimethyl-1,3-benzoxazol-2-amine;4-(9,9-dimethylfluoren-2-yl)-1,3-benzothiazole;4-[4-(1,1,1,3,3,3-hexafluoropropan-2-yl)phenyl]-1,3-benzothiazole;4-(2-methylphenyl)-1,3-benzothiazole;4-(3-methylphenyl)-1,3-benzothiazole;4-(4-methylphenyl)-1,3-benzothiazole;4-naphthalen-1-yl-1,3-benzothiazole;4-phenyl-1,3-benzothiazole;4-(4-phenylphenyl)-1,3-benzothiazole;4-[2-(trifluoromethyl)phenyl]-1,3-benzothiazole;4-[4-(trifluoromethyl)phenyl]-1,3-benzothiazole

[4-(1,3-benzothiazol-4-yl)phenyl]-trimethylsilane;4-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-N,N-dimethyl-1,3-benzoxazol-2-amine;4-(9,9-dimethylfluoren-2-yl)-1,3-benzothiazole;4-[4-(1,1,1,3,3,3-hexafluoropropan-2-yl)phenyl]-1,3-benzothiazole;4-(2-methylphenyl)-1,3-benzothiazole;4-(3-methylphenyl)-1,3-benzothiazole;4-(4-methylphenyl)-1,3-benzothiazole;4-naphthalen-1-yl-1,3-benzothiazole;4-phenyl-1,3-benzothiazole;4-(4-phenylphenyl)-1,3-benzothiazole;4-[2-(trifluoromethyl)phenyl]-1,3-benzothiazole;4-[4-(trifluoromethyl)phenyl]-1,3-benzothiazole (PubChem CID 158177825) has the molecular formula C196H147F12N13OS11Si2 and a molecular weight of 3337.31 g/mol. Its IUPAC name is [4-(1,3-benzothiazol-4-yl)phenyl]-trimethylsilane;4-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-N,N-dimethyl-1,3-benzoxazol-2-amine;4-(9,9-dimethylfluoren-2-yl)-1,3-benzothiazole;4-[4-(1,1,1,3,3,3-hexafluoropropan-2-yl)phenyl]-1,3-benzothiazole;4-(2-methylphenyl)-1,3-benzothiazole;4-(3-methylphenyl)-1,3-benzothiazole;4-(4-methylphenyl)-1,3-benzothiazole;4-naphthalen-1-yl-1,3-benzothiazole;4-phenyl-1,3-benzothiazole;4-(4-phenylphenyl)-1,3-benzothiazole;4-[2-(trifluoromethyl)phenyl]-1,3-benzothiazole;4-[4-(trifluoromethyl)phenyl]-1,3-benzothiazole.

Molecular Properties

Compound Name[4-(1,3-benzothiazol-4-yl)phenyl]-trimethylsilane;4-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-N,N-dimethyl-1,3-benzoxazol-2-amine;4-(9,9-dimethylfluoren-2-yl)-1,3-benzothiazole;4-[4-(1,1,1,3,3,3-hexafluoropropan-2-yl)phenyl]-1,3-benzothiazole;4-(2-methylphenyl)-1,3-benzothiazole;4-(3-methylphenyl)-1,3-benzothiazole;4-(4-methylphenyl)-1,3-benzothiazole;4-naphthalen-1-yl-1,3-benzothiazole;4-phenyl-1,3-benzothiazole;4-(4-phenylphenyl)-1,3-benzothiazole;4-[2-(trifluoromethyl)phenyl]-1,3-benzothiazole;4-[4-(trifluoromethyl)phenyl]-1,3-benzothiazole
PubChem CID158177825
Molecular FormulaC196H147F12N13OS11Si2
Molecular Weight3337.31 g/mol
Exact Mass3333.81
IUPAC Name[4-(1,3-benzothiazol-4-yl)phenyl]-trimethylsilane;4-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-N,N-dimethyl-1,3-benzoxazol-2-amine;4-(9,9-dimethylfluoren-2-yl)-1,3-benzothiazole;4-[4-(1,1,1,3,3,3-hexafluoropropan-2-yl)phenyl]-1,3-benzothiazole;4-(2-methylphenyl)-1,3-benzothiazole;4-(3-methylphenyl)-1,3-benzothiazole;4-(4-methylphenyl)-1,3-benzothiazole;4-naphthalen-1-yl-1,3-benzothiazole;4-phenyl-1,3-benzothiazole;4-(4-phenylphenyl)-1,3-benzothiazole;4-[2-(trifluoromethyl)phenyl]-1,3-benzothiazole;4-[4-(trifluoromethyl)phenyl]-1,3-benzothiazole
SMILESCC1(C)c2ccccc2-c2ccc(-c3cccc4scnc34)cc21.CN(C)c1nc2c(-c3ccc4c(c3)[Si](C)(C)c3ccccc3-4)cccc2o1.C[Si](C)(C)c1ccc(-c2cccc3scnc23)cc1.Cc1ccc(-c2cccc3scnc23)cc1.Cc1cccc(-c2cccc3scnc23)c1.Cc1ccccc1-c1cccc2scnc12.FC(F)(F)C(c1ccc(-c2cccc3scnc23)cc1)C(F)(F)F.FC(F)(F)c1ccc(-c2cccc3scnc23)cc1.FC(F)(F)c1ccccc1-c1cccc2scnc12.c1ccc(-c2ccc(-c3cccc4scnc34)cc2)cc1.c1ccc(-c2cccc3scnc23)cc1.c1ccc2c(-c3cccc4scnc34)cccc2c1
InChIInChI=1S/C23H22N2OSi.C22H17NS.C19H13NS.C17H11NS.C16H9F6NS.C16H17NSSi.2C14H8F3NS.3C14H11NS.C13H9NS/c1-25(2)23-24-22-16(9-7-10-19(22)26-23)15-12-13-18-17-8-5-6-11-20(17)27(3,4)21(18)14-15;1-22(2)18-8-4-3-6-16(18)17-11-10-14(12-19(17)22)15-7-5-9-20-21(15)23-13-24-20;1-2-5-14(6-3-1)15-9-11-16(12-10-15)17-7-4-8-18-19(17)20-13-21-18;1-2-7-13-12(5-1)6-3-8-14(13)15-9-4-10-16-17(15)18-11-19-16;17-15(18,19)14(16(20,21)22)10-6-4-9(5-7-10)11-2-1-3-12-13(11)23-8-24-12;1-19(2,3)13-9-7-12(8-10-13)14-5-4-6-15-16(14)17-11-18-15;15-14(16,17)11-6-2-1-4-9(11)10-5-3-7-12-13(10)18-8-19-12;15-14(16,17)10-6-4-9(5-7-10)11-2-1-3-12-13(11)18-8-19-12;1-10-4-2-5-11(8-10)12-6-3-7-13-14(12)15-9-16-13;1-10-5-2-3-6-11(10)12-7-4-8-13-14(12)15-9-16-13;1-10-5-7-11(8-6-10)12-3-2-4-13-14(12)15-9-16-13;1-2-5-10(6-3-1)11-7-4-8-12-13(11)14-9-15-12/h5-14H,1-4H3;3-13H,1-2H3;1-13H;1-11H;1-8,14H;4-11H,1-3H3;2*1-8H;3*2-9H,1H3;1-9H
InChIKeyFYFDTCPSYQEWQR-UHFFFAOYSA-N
XLogP58.80
TPSA171.06 Ų
H-Bond Donors
H-Bond Acceptors25
Rotatable Bonds16
Heavy Atoms235
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003337.31
LogP ≤ 558.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1025

Computed Properties (RDKit)

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

Analyze [4-(1,3-benzothiazol-4-yl)phenyl]-trimethylsilane;4-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-N,N-dimethyl-1,3-benzoxazol-2-amine;4-(9,9-dimethylfluoren-2-yl)-1,3-benzothiazole;4-[4-(1,1,1,3,3,3-hexafluoropropan-2-yl)phenyl]-1,3-benzothiazole;4-(2-methylphenyl)-1,3-benzothiazole;4-(3-methylphenyl)-1,3-benzothiazole;4-(4-methylphenyl)-1,3-benzothiazole;4-naphthalen-1-yl-1,3-benzothiazole;4-phenyl-1,3-benzothiazole;4-(4-phenylphenyl)-1,3-benzothiazole;4-[2-(trifluoromethyl)phenyl]-1,3-benzothiazole;4-[4-(trifluoromethyl)phenyl]-1,3-benzothiazole with MolForge

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Related Compounds

Benzo[g][1,3]benzothiazol-2-yl-dimethyl-(8-methylnaphthalen-2-yl)silane;benzo[g][1,3]benzothiazol-2-yl-dimethyl-naphthalen-1-ylsilane;benzo[g][1,3]benzothiazol-2-yl-dimethyl-[4-(trifluoromethyl)phenyl]silane;benzo[g][1,3]benzoxazol-2-yl-dimethyl-(4-phenylphenyl)silane;benzo[g][1,3]benzoxazol-2-yl-dimethyl-phenylsilane;1,3-benzothiazol-2-yl-dimethyl-thiophen-3-ylsilane;(5-tert-butylthiophen-3-yl)-dimethyl-(6-methyl-1,3-benzothiazol-2-yl)silane;dimethyl-(7-methyl-1,3-benzothiazol-2-yl)-(5-methylthiophen-3-yl)silane
CID 157912259
4-(9,9-dimethylfluoren-2-yl)-N,N-dimethyl-1,3-benzoxazol-2-amine;N,N-dimethyl-4-naphthalen-1-yl-1,3-benzoxazol-2-amine;N,N-dimethyl-4-naphthalen-2-yl-1,3-benzoxazol-2-amine;N,N-dimethyl-4-(3-phenylphenyl)-1,3-benzoxazol-2-amine;N,N-dimethyl-4-(4-phenylphenyl)-1,3-benzoxazol-2-amine;N,N-dimethyl-4-[2-(trifluoromethyl)phenyl]-1,3-benzoxazol-2-amine;N,N-dimethyl-4-[4-(trifluoromethyl)phenyl]-1,3-benzoxazol-2-amine;4-[4-(1,1,1,3,3,3-hexafluoropropan-2-yl)phenyl]-N,N-dimethyl-1,3-benzoxazol-2-amine;4-(3-phenylphenyl)-1,3-benzoxazole
CID 157989900
2,5-dimethylthieno[3,2-e][1,3]benzothiazole;2,7-dimethylthieno[3,2-e][1,3]benzothiazole;2-methylthieno[3,2-e][1,3]benzothiazole;5-methyl-2-(trifluoromethyl)thieno[3,2-e][1,3]benzothiazole;5-(trifluoromethyl)thieno[3,2-e][1,3]benzothiazole;2,5,7-trimethylthieno[3,2-e][1,3]benzothiazole;N,N,7-trimethylthieno[3,2-e][1,3]benzoxazol-2-amine;2,5,7-tris(trifluoromethyl)thieno[3,2-e][1,3]benzothiazole
CID 158298569
Benzo[f][1,3]benzothiazol-2-yl-dimethyl-naphthalen-2-ylsilane;benzo[f][1,3]benzoxazol-2-yl-dimethyl-phenylsilane;[5,6-bis(trifluoromethyl)-1,3-benzothiazol-2-yl]-dimethyl-[4-(trifluoromethyl)phenyl]silane;(6,7-dimethyl-1,3-benzoxazol-2-yl)-dimethyl-(4-phenylphenyl)silane;dimethyl-(6-methyl-1,3-benzothiazol-2-yl)-naphthalen-1-ylsilane;dimethyl-naphthalen-2-yl-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]silane;dimethyl-phenyl-(4,5,6,7-tetramethyl-1,3-benzoxazol-2-yl)silane
CID 159201572
benzo[e][1,3]benzoxazole;2,7-dimethylbenzo[e][1,3]benzoxazole;2-methyl-7-phenylbenzo[e][1,3]benzoxazole;2-methyl-7-(trifluoromethyl)thieno[3,2-e][1,3]benzothiazole;trimethyl-(2-methylthieno[3,2-e][1,3]benzothiazol-7-yl)silane;N,N,7-trimethylthieno[3,2-e][1,3]benzothiazol-2-amine
CID 160002430
1,3-Benzothiazol-2-yl-dimethyl-naphthalen-1-ylsilane;1,3-benzothiazol-2-yl-dimethyl-phenylsilane;[3,4-bis(trifluoromethyl)phenyl]-dimethyl-(6-phenyl-1,3-benzoxazol-2-yl)silane;dimethyl-naphthalen-2-yl-(6-phenyl-1,3-benzoxazol-2-yl)silane;dimethyl-naphthalen-1-yl-(6-trimethylsilyl-1,3-benzothiazol-2-yl)silane;dimethyl-naphthalen-2-yl-(6-trimethylsilyl-1,3-benzothiazol-2-yl)silane;dimethyl-(6-phenyl-1,3-benzothiazol-2-yl)-(4-phenylphenyl)silane
CID 160326364
benzo[e][1,3]benzothiazole;2,7-dimethylbenzo[e][1,3]benzothiazole;20,20-dimethyl-7-oxa-5-aza-20-silapentacyclo[11.7.0.03,11.04,8.014,19]icosa-1(13),2,4(8),5,9,11,14,16,18-nonaene;N,N,20,20-tetramethyl-7-oxa-5-aza-20-silapentacyclo[11.7.0.03,11.04,8.014,19]icosa-1(13),2,4(8),5,9,11,14,16,18-nonaen-6-amine;6,20,20-trimethyl-7-oxa-5-aza-20-silapentacyclo[11.7.0.03,11.04,8.014,19]icosa-1(13),2,4(8),5,9,11,14,16,18-nonaene
CID 157093001
CID 159921247
CID 159921247

Frequently Asked Questions

What is the IUPAC name of [4-(1,3-benzothiazol-4-yl)phenyl]-trimethylsilane;4-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-N,N-dimethyl-1,3-benzoxazol-2-amine;4-(9,9-dimethylfluoren-2-yl)-1,3-benzothiazole;4-[4-(1,1,1,3,3,3-hexafluoropropan-2-yl)phenyl]-1,3-benzothiazole;4-(2-methylphenyl)-1,3-benzothiazole;4-(3-methylphenyl)-1,3-benzothiazole;4-(4-methylphenyl)-1,3-benzothiazole;4-naphthalen-1-yl-1,3-benzothiazole;4-phenyl-1,3-benzothiazole;4-(4-phenylphenyl)-1,3-benzothiazole;4-[2-(trifluoromethyl)phenyl]-1,3-benzothiazole;4-[4-(trifluoromethyl)phenyl]-1,3-benzothiazole?
The IUPAC name of [4-(1,3-benzothiazol-4-yl)phenyl]-trimethylsilane;4-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-N,N-dimethyl-1,3-benzoxazol-2-amine;4-(9,9-dimethylfluoren-2-yl)-1,3-benzothiazole;4-[4-(1,1,1,3,3,3-hexafluoropropan-2-yl)phenyl]-1,3-benzothiazole;4-(2-methylphenyl)-1,3-benzothiazole;4-(3-methylphenyl)-1,3-benzothiazole;4-(4-methylphenyl)-1,3-benzothiazole;4-naphthalen-1-yl-1,3-benzothiazole;4-phenyl-1,3-benzothiazole;4-(4-phenylphenyl)-1,3-benzothiazole;4-[2-(trifluoromethyl)phenyl]-1,3-benzothiazole;4-[4-(trifluoromethyl)phenyl]-1,3-benzothiazole (CID 158177825) is [4-(1,3-benzothiazol-4-yl)phenyl]-trimethylsilane;4-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-N,N-dimethyl-1,3-benzoxazol-2-amine;4-(9,9-dimethylfluoren-2-yl)-1,3-benzothiazole;4-[4-(1,1,1,3,3,3-hexafluoropropan-2-yl)phenyl]-1,3-benzothiazole;4-(2-methylphenyl)-1,3-benzothiazole;4-(3-methylphenyl)-1,3-benzothiazole;4-(4-methylphenyl)-1,3-benzothiazole;4-naphthalen-1-yl-1,3-benzothiazole;4-phenyl-1,3-benzothiazole;4-(4-phenylphenyl)-1,3-benzothiazole;4-[2-(trifluoromethyl)phenyl]-1,3-benzothiazole;4-[4-(trifluoromethyl)phenyl]-1,3-benzothiazole.
What is the SMILES notation for [4-(1,3-benzothiazol-4-yl)phenyl]-trimethylsilane;4-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-N,N-dimethyl-1,3-benzoxazol-2-amine;4-(9,9-dimethylfluoren-2-yl)-1,3-benzothiazole;4-[4-(1,1,1,3,3,3-hexafluoropropan-2-yl)phenyl]-1,3-benzothiazole;4-(2-methylphenyl)-1,3-benzothiazole;4-(3-methylphenyl)-1,3-benzothiazole;4-(4-methylphenyl)-1,3-benzothiazole;4-naphthalen-1-yl-1,3-benzothiazole;4-phenyl-1,3-benzothiazole;4-(4-phenylphenyl)-1,3-benzothiazole;4-[2-(trifluoromethyl)phenyl]-1,3-benzothiazole;4-[4-(trifluoromethyl)phenyl]-1,3-benzothiazole?
The canonical SMILES for [4-(1,3-benzothiazol-4-yl)phenyl]-trimethylsilane;4-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-N,N-dimethyl-1,3-benzoxazol-2-amine;4-(9,9-dimethylfluoren-2-yl)-1,3-benzothiazole;4-[4-(1,1,1,3,3,3-hexafluoropropan-2-yl)phenyl]-1,3-benzothiazole;4-(2-methylphenyl)-1,3-benzothiazole;4-(3-methylphenyl)-1,3-benzothiazole;4-(4-methylphenyl)-1,3-benzothiazole;4-naphthalen-1-yl-1,3-benzothiazole;4-phenyl-1,3-benzothiazole;4-(4-phenylphenyl)-1,3-benzothiazole;4-[2-(trifluoromethyl)phenyl]-1,3-benzothiazole;4-[4-(trifluoromethyl)phenyl]-1,3-benzothiazole is CC1(C)c2ccccc2-c2ccc(-c3cccc4scnc34)cc21.CN(C)c1nc2c(-c3ccc4c(c3)[Si](C)(C)c3ccccc3-4)cccc2o1.C[Si](C)(C)c1ccc(-c2cccc3scnc23)cc1.Cc1ccc(-c2cccc3scnc23)cc1.Cc1cccc(-c2cccc3scnc23)c1.Cc1ccccc1-c1cccc2scnc12.FC(F)(F)C(c1ccc(-c2cccc3scnc23)cc1)C(F)(F)F.FC(F)(F)c1ccc(-c2cccc3scnc23)cc1.FC(F)(F)c1ccccc1-c1cccc2scnc12.c1ccc(-c2ccc(-c3cccc4scnc34)cc2)cc1.c1ccc(-c2cccc3scnc23)cc1.c1ccc2c(-c3cccc4scnc34)cccc2c1.
What is the InChIKey of [4-(1,3-benzothiazol-4-yl)phenyl]-trimethylsilane;4-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-N,N-dimethyl-1,3-benzoxazol-2-amine;4-(9,9-dimethylfluoren-2-yl)-1,3-benzothiazole;4-[4-(1,1,1,3,3,3-hexafluoropropan-2-yl)phenyl]-1,3-benzothiazole;4-(2-methylphenyl)-1,3-benzothiazole;4-(3-methylphenyl)-1,3-benzothiazole;4-(4-methylphenyl)-1,3-benzothiazole;4-naphthalen-1-yl-1,3-benzothiazole;4-phenyl-1,3-benzothiazole;4-(4-phenylphenyl)-1,3-benzothiazole;4-[2-(trifluoromethyl)phenyl]-1,3-benzothiazole;4-[4-(trifluoromethyl)phenyl]-1,3-benzothiazole?
The InChIKey is FYFDTCPSYQEWQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2OSi.C22H17NS.C19H13NS.C17H11NS.C16H9F6NS.C16H17NSSi.2C14H8F3NS.3C14H11NS.C13H9NS/c1-25(2)23-24-22-16(9-7-10-19(22)26-23)15-12-13-18-17-8-5-6-11-20(17)27(3,4)21(18)14-15;1-22(2)18-8-4-3-6-16(18)17-11-10-14(12-19(17)22)15-7-5-9-20-21(15)23-13-24-20;1-2-5-14(6-3-1)15-9-11-16(12-10-15)17-7-4-8-18-19(17)20-13-21-18;1-2-7-13-12(5-1)6-3-8-14(13)15-9-4-10-16-17(15)18-11-19-16;17-15(18,19)14(16(20,21)22)10-6-4-9(5-7-10)11-2-1-3-12-13(11)23-8-24-12;1-19(2,3)13-9-7-12(8-10-13)14-5-4-6-15-16(14)17-11-18-15;15-14(16,17)11-6-2-1-4-9(11)10-5-3-7-12-13(10)18-8-19-12;15-14(16,17)10-6-4-9(5-7-10)11-2-1-3-12-13(11)18-8-19-12;1-10-4-2-5-11(8-10)12-6-3-7-13-14(12)15-9-16-13;1-10-5-2-3-6-11(10)12-7-4-8-13-14(12)15-9-16-13;1-10-5-7-11(8-6-10)12-3-2-4-13-14(12)15-9-16-13;1-2-5-10(6-3-1)11-7-4-8-12-13(11)14-9-15-12/h5-14H,1-4H3;3-13H,1-2H3;1-13H;1-11H;1-8,14H;4-11H,1-3H3;2*1-8H;3*2-9H,1H3;1-9H.
What are the key properties of [4-(1,3-benzothiazol-4-yl)phenyl]-trimethylsilane;4-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-N,N-dimethyl-1,3-benzoxazol-2-amine;4-(9,9-dimethylfluoren-2-yl)-1,3-benzothiazole;4-[4-(1,1,1,3,3,3-hexafluoropropan-2-yl)phenyl]-1,3-benzothiazole;4-(2-methylphenyl)-1,3-benzothiazole;4-(3-methylphenyl)-1,3-benzothiazole;4-(4-methylphenyl)-1,3-benzothiazole;4-naphthalen-1-yl-1,3-benzothiazole;4-phenyl-1,3-benzothiazole;4-(4-phenylphenyl)-1,3-benzothiazole;4-[2-(trifluoromethyl)phenyl]-1,3-benzothiazole;4-[4-(trifluoromethyl)phenyl]-1,3-benzothiazole?
[4-(1,3-benzothiazol-4-yl)phenyl]-trimethylsilane;4-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-N,N-dimethyl-1,3-benzoxazol-2-amine;4-(9,9-dimethylfluoren-2-yl)-1,3-benzothiazole;4-[4-(1,1,1,3,3,3-hexafluoropropan-2-yl)phenyl]-1,3-benzothiazole;4-(2-methylphenyl)-1,3-benzothiazole;4-(3-methylphenyl)-1,3-benzothiazole;4-(4-methylphenyl)-1,3-benzothiazole;4-naphthalen-1-yl-1,3-benzothiazole;4-phenyl-1,3-benzothiazole;4-(4-phenylphenyl)-1,3-benzothiazole;4-[2-(trifluoromethyl)phenyl]-1,3-benzothiazole;4-[4-(trifluoromethyl)phenyl]-1,3-benzothiazole has a molecular weight of 3337.31 g/mol, XLogP of 58.80, 16 rotatable bonds, 0 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(1,3-benzothiazol-4-yl)phenyl]-trimethylsilane;4-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-N,N-dimethyl-1,3-benzoxazol-2-amine;4-(9,9-dimethylfluoren-2-yl)-1,3-benzothiazole;4-[4-(1,1,1,3,3,3-hexafluoropropan-2-yl)phenyl]-1,3-benzothiazole;4-(2-methylphenyl)-1,3-benzothiazole;4-(3-methylphenyl)-1,3-benzothiazole;4-(4-methylphenyl)-1,3-benzothiazole;4-naphthalen-1-yl-1,3-benzothiazole;4-phenyl-1,3-benzothiazole;4-(4-phenylphenyl)-1,3-benzothiazole;4-[2-(trifluoromethyl)phenyl]-1,3-benzothiazole;4-[4-(trifluoromethyl)phenyl]-1,3-benzothiazole is sourced from PubChem (CID 158177825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).