5-(4-heptoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1,2,4-oxadiazole;2-(4-hexoxyphenyl)-4-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;4-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1H-pyrazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-thiazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)thiophene;5-(4-pentoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole

C292H329N13O19S2 — CID 158567642

IUPAC5-(4-heptoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1,2,4-oxadiazole;2-(4-hexoxyphenyl)-4-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;4-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1H-pyrazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-thiazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)thiophene;5-(4-pentoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole
SMILESC=C(C)c1ccc(-c2cc(-c3ccc(OCCCCCC)cc3)n[nH]2)cc1.C=C(C)c1ccc(-c2cc(-c3ccc(OCCCCCC)cc3)on2)cc1.C=C(C)c1ccc(-c2cc(-c3ccc(OCCCCCCC)cc3)on2)cc1.C=C(C)c1ccc(-c2ccc(-c3ccc(OCCCCCC)cc3)cn2)cc1.C=C(C)c1ccc(-c2ccc(-c3ccc(OCCCCCC)cc3)nc2)cc1.C=C(C)c1ccc(-c2ccc(-c3ccc(OCCCCCC)cc3)s2)cc1.C=C(C)c1ccc(-c2coc(-c3ccc(OCCCCCC)cc3)n2)cc1.C=C(C)c1ccc(-c2nc(-c3ccc(OCCCCCC)cc3)co2)cc1.C=C(C)c1ccc(-c2nc(-c3ccc(OCCCCCC)cc3)no2)cc1.C=C(C)c1ccc(-c2ncc(-c3ccc(OCCCCC)cc3)o2)cc1.C=C(C)c1ccc(-c2ncc(-c3ccc(OCCCCCC)cc3)o2)cc1.C=C(C)c1ccc(-c2ncc(-c3ccc(OCCCCCC)cc3)s2)cc1
InChIInChI=1S/2C26H29NO.C25H29NO2.C25H28OS.C24H28N2O.4C24H27NO2.C24H27NOS.C23H26N2O2.C23H25NO2/c1-4-5-6-7-18-28-25-15-12-22(13-16-25)24-14-17-26(27-19-24)23-10-8-21(9-11-23)20(2)3;1-4-5-6-7-18-28-25-15-12-23(13-16-25)26-17-14-24(19-27-26)22-10-8-21(9-11-22)20(2)3;1-4-5-6-7-8-17-27-23-15-13-22(14-16-23)25-18-24(26-28-25)21-11-9-20(10-12-21)19(2)3;1-4-5-6-7-18-26-23-14-12-22(13-15-23)25-17-16-24(27-25)21-10-8-20(9-11-21)19(2)3;1-4-5-6-7-16-27-22-14-12-21(13-15-22)24-17-23(25-26-24)20-10-8-19(9-11-20)18(2)3;1-4-5-6-7-16-26-22-14-12-20(13-15-22)23-17-27-24(25-23)21-10-8-19(9-11-21)18(2)3;1-4-5-6-7-16-26-22-14-12-20(13-15-22)23-17-25-24(27-23)21-10-8-19(9-11-21)18(2)3;1-4-5-6-7-16-26-22-14-12-21(13-15-22)24-25-23(17-27-24)20-10-8-19(9-11-20)18(2)3;1-4-5-6-7-16-26-22-14-12-21(13-15-22)24-17-23(25-27-24)20-10-8-19(9-11-20)18(2)3;1-4-5-6-7-16-26-22-14-12-20(13-15-22)23-17-25-24(27-23)21-10-8-19(9-11-21)18(2)3;1-4-5-6-7-16-26-21-14-12-19(13-15-21)22-24-23(27-25-22)20-10-8-18(9-11-20)17(2)3;1-4-5-6-15-25-21-13-11-19(12-14-21)22-16-24-23(26-22)20-9-7-18(8-10-20)17(2)3/h2*8-17,19H,2,4-7,18H2,1,3H3;9-16,18H,2,4-8,17H2,1,3H3;8-17H,2,4-7,18H2,1,3H3;8-15,17H,2,4-7,16H2,1,3H3,(H,25,26);5*8-15,17H,2,4-7,16H2,1,3H3;8-15H,2,4-7,16H2,1,3H3;7-14,16H,2,4-6,15H2,1,3H3
InChIKeyHRRISMYHQVWCKT-UHFFFAOYSA-N
MW4389.05 g/mol
LogP85.50
Rot. Bonds108

About 5-(4-heptoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1,2,4-oxadiazole;2-(4-hexoxyphenyl)-4-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;4-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1H-pyrazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-thiazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)thiophene;5-(4-pentoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole

5-(4-heptoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1,2,4-oxadiazole;2-(4-hexoxyphenyl)-4-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;4-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1H-pyrazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-thiazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)thiophene;5-(4-pentoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole (PubChem CID 158567642) has the molecular formula C292H329N13O19S2 and a molecular weight of 4389.05 g/mol. Its IUPAC name is 5-(4-heptoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1,2,4-oxadiazole;2-(4-hexoxyphenyl)-4-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;4-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1H-pyrazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-thiazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)thiophene;5-(4-pentoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole.

Molecular Properties

Compound Name5-(4-heptoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1,2,4-oxadiazole;2-(4-hexoxyphenyl)-4-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;4-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1H-pyrazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-thiazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)thiophene;5-(4-pentoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole
PubChem CID158567642
Molecular FormulaC292H329N13O19S2
Molecular Weight4389.05 g/mol
Exact Mass4385.46
IUPAC Name5-(4-heptoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1,2,4-oxadiazole;2-(4-hexoxyphenyl)-4-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;4-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1H-pyrazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-thiazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)thiophene;5-(4-pentoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole
SMILESC=C(C)c1ccc(-c2cc(-c3ccc(OCCCCCC)cc3)n[nH]2)cc1.C=C(C)c1ccc(-c2cc(-c3ccc(OCCCCCC)cc3)on2)cc1.C=C(C)c1ccc(-c2cc(-c3ccc(OCCCCCCC)cc3)on2)cc1.C=C(C)c1ccc(-c2ccc(-c3ccc(OCCCCCC)cc3)cn2)cc1.C=C(C)c1ccc(-c2ccc(-c3ccc(OCCCCCC)cc3)nc2)cc1.C=C(C)c1ccc(-c2ccc(-c3ccc(OCCCCCC)cc3)s2)cc1.C=C(C)c1ccc(-c2coc(-c3ccc(OCCCCCC)cc3)n2)cc1.C=C(C)c1ccc(-c2nc(-c3ccc(OCCCCCC)cc3)co2)cc1.C=C(C)c1ccc(-c2nc(-c3ccc(OCCCCCC)cc3)no2)cc1.C=C(C)c1ccc(-c2ncc(-c3ccc(OCCCCC)cc3)o2)cc1.C=C(C)c1ccc(-c2ncc(-c3ccc(OCCCCCC)cc3)o2)cc1.C=C(C)c1ccc(-c2ncc(-c3ccc(OCCCCCC)cc3)s2)cc1
InChIInChI=1S/2C26H29NO.C25H29NO2.C25H28OS.C24H28N2O.4C24H27NO2.C24H27NOS.C23H26N2O2.C23H25NO2/c1-4-5-6-7-18-28-25-15-12-22(13-16-25)24-14-17-26(27-19-24)23-10-8-21(9-11-23)20(2)3;1-4-5-6-7-18-28-25-15-12-23(13-16-25)26-17-14-24(19-27-26)22-10-8-21(9-11-22)20(2)3;1-4-5-6-7-8-17-27-23-15-13-22(14-16-23)25-18-24(26-28-25)21-11-9-20(10-12-21)19(2)3;1-4-5-6-7-18-26-23-14-12-22(13-15-23)25-17-16-24(27-25)21-10-8-20(9-11-21)19(2)3;1-4-5-6-7-16-27-22-14-12-21(13-15-22)24-17-23(25-26-24)20-10-8-19(9-11-20)18(2)3;1-4-5-6-7-16-26-22-14-12-20(13-15-22)23-17-27-24(25-23)21-10-8-19(9-11-21)18(2)3;1-4-5-6-7-16-26-22-14-12-20(13-15-22)23-17-25-24(27-23)21-10-8-19(9-11-21)18(2)3;1-4-5-6-7-16-26-22-14-12-21(13-15-22)24-25-23(17-27-24)20-10-8-19(9-11-20)18(2)3;1-4-5-6-7-16-26-22-14-12-21(13-15-22)24-17-23(25-27-24)20-10-8-19(9-11-20)18(2)3;1-4-5-6-7-16-26-22-14-12-20(13-15-22)23-17-25-24(27-23)21-10-8-19(9-11-21)18(2)3;1-4-5-6-7-16-26-21-14-12-19(13-15-21)22-24-23(27-25-22)20-10-8-18(9-11-20)17(2)3;1-4-5-6-15-25-21-13-11-19(12-14-21)22-16-24-23(26-22)20-9-7-18(8-10-20)17(2)3/h2*8-17,19H,2,4-7,18H2,1,3H3;9-16,18H,2,4-8,17H2,1,3H3;8-17H,2,4-7,18H2,1,3H3;8-15,17H,2,4-7,16H2,1,3H3,(H,25,26);5*8-15,17H,2,4-7,16H2,1,3H3;8-15H,2,4-7,16H2,1,3H3;7-14,16H,2,4-6,15H2,1,3H3
InChIKeyHRRISMYHQVWCKT-UHFFFAOYSA-N
XLogP85.50
TPSA373.21 Ų
H-Bond Donors1
H-Bond Acceptors33
Rotatable Bonds108
Heavy Atoms326
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004389.05
LogP ≤ 585.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1033

Analyze 5-(4-heptoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1,2,4-oxadiazole;2-(4-hexoxyphenyl)-4-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;4-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1H-pyrazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-thiazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)thiophene;5-(4-pentoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole with MolForge

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Related Compounds

CID 160278972
CID 160278972
CID 161331998
CID 161331998
CID 161434547
CID 161434547
4-[3-[2-[2-[2-[(4-phenyl-1,3-thiazol-5-yl)sulfanyl]furan-3-yl]-1H-pyrrol-3-yl]-1,3-oxazol-4-yl]-1,2-oxazol-4-yl]-5-[4-[4-[5-[4-[3-[3-[4-(1H-pyrazol-3-yloxy)pyrimidin-2-yl]-2-pyridinyl]pyrazin-2-yl]pyridazin-3-yl]thiadiazol-4-yl]-1H-imidazol-2-yl]-1H-pyrazol-3-yl]oxadiazole
CID 123454194
2-amino-5-[2-(difluoromethyl)-4-pyridinyl]-5-[3-methoxy-5-(2-methylpyrimidin-5-yl)phenyl]-3-methylimidazol-4-one;2-amino-5-[2-(difluoromethyl)-4-pyridinyl]-5-[3-methoxy-5-(1,2-oxazol-3-yl)phenyl]-3-methylimidazol-4-one;2-amino-5-[2-(difluoromethyl)-4-pyridinyl]-5-[3-methoxy-5-(1,3-oxazol-5-yl)phenyl]-3-methylimidazol-4-one;2-amino-5-[2-(difluoromethyl)-4-pyridinyl]-5-[3-methoxy-5-(1H-pyrazol-5-yl)phenyl]-3-methylimidazol-4-one;2-amino-5-[2-(difluoromethyl)-4-pyridinyl]-5-[3-methoxy-5-(1,3-thiazol-5-yl)phenyl]-3-methylimidazol-4-one
CID 157158078
5-(4-heptoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;1-heptoxy-4-[4-(4-prop-1-en-2-ylphenyl)phenyl]benzene;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1,2,4-oxadiazole;2-(4-hexoxyphenyl)-4-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;4-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1H-pyrazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-thiazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)thiophene;1-hexoxy-4-[4-(4-prop-1-en-2-ylphenyl)phenyl]benzene;5-(4-pentoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;1-pentoxy-4-[4-(4-prop-1-en-2-ylphenyl)phenyl]benzene
CID 157185213
2,4-dimethyl-5-propan-2-yl-1,3-oxazole;4,5-dimethyl-3-propan-2-yl-1,2-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;2,3-dimethyl-5-propan-2-yl-1H-pyrazol-2-ium;2,4-dimethyl-5-propan-2-yl-1,3-thiazole;2,5-dimethyl-4-propan-2-yl-1,3-thiazole;2-[(E)-3-methylbut-1-enyl]furan;2-[(E)-3-methylbut-1-enyl]pyridine;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;3-methyl-5-propan-2-yl-1,2-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;3-methyl-5-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;3-methyl-5-propan-2-yl-4H-triazol-3-ium;2-propan-2-ylpyrazine;2-propan-2-ylpyridine
CID 157262008
3-[2-(3-tert-butylphenyl)-1H-imidazol-5-yl]pyridine;2-(3-tert-butylphenyl)-5-phenyl-1H-imidazole;5-(3-tert-butylphenyl)-2-phenyl-1H-imidazole;2-(3-tert-butylphenyl)-5-phenyl-1,3-oxazole;5-(3-tert-butylphenyl)-2-phenyl-1,3-oxazole;5-(3-tert-butylphenyl)-3-phenyl-1,2-oxazole;3-(3-tert-butylphenyl)-5-phenyl-1H-pyrazole;2-(3-tert-butylphenyl)-5-phenyl-1,3-thiazole;5-(3-tert-butylphenyl)-2-phenyl-1,3-thiazole;3-tert-butyl-5-(5-phenyl-1H-pyrazol-3-yl)pyridine
CID 157381358
5-cyclohexyl-3-methyl-1,2-oxazole;5-methyl-2-phenyl-1H-imidazole;2-methyl-5-phenyl-1,3,4-oxadiazole;3-methyl-5-phenyl-1,2,4-oxadiazole;5-methyl-3-phenyl-1,2,4-oxadiazole;3-methyl-5-phenyl-1,2-oxazole;4-methyl-2-phenyl-1,3-oxazole;5-methyl-3-phenyl-1,2-oxazole;5-methyl-3-phenyl-1H-pyrazole;2-methyl-5-phenyl-1,3-thiazole
CID 158000298
2-tert-butyl-1-benzofuran;3-tert-butyl-1-benzofuran;2-tert-butyl-1H-imidazole;5-tert-butyl-1H-imidazole;2-tert-butyl-1H-indole;3-tert-butyl-1H-indole;3-tert-butyl-1-methylindole;2-tert-butyl-1,3,4-oxadiazole;3-tert-butyl-1,2,4-oxadiazole;5-tert-butyl-1,2,4-oxadiazole;2-tert-butyl-1,3-oxazole;3-tert-butyl-1,2-oxazole;4-tert-butyl-1,2-oxazole;4-tert-butyl-1,3-oxazole;5-tert-butyl-1,2-oxazole;5-tert-butyl-1,3-oxazole;4-tert-butyl-1H-pyrazole;bis(5-tert-butyl-1H-pyrazole);2-tert-butyl-1,3-thiazole;4-tert-butyl-1,3-thiazole;5-tert-butyl-1,3-thiazole;3-tert-butylthiophene;5-tert-butyl-1H-1,2,4-triazole
CID 158016099
1-Methyl-4-(4-octoxyphenyl)benzene;4-[5-(4-pentoxyphenyl)furan-2-yl]benzaldehyde;4-[2-(4-pentoxyphenyl)-1,3-oxazol-5-yl]benzaldehyde;4-[5-(4-pentoxyphenyl)-1,2-oxazol-3-yl]benzaldehyde;4-[5-(4-pentoxyphenyl)-1,3,4-thiadiazol-2-yl]benzaldehyde;4-[5-(4-pentoxyphenyl)thiophen-2-yl]benzaldehyde
CID 158060761
tert-butylbenzene;3-tert-butylfuran;5-tert-butyl-1H-imidazole;4-tert-butyl-1,2-oxazole;4-tert-butyl-1,3-oxazole;4-tert-butyl-1H-pyrazole;3-tert-butyl-1H-pyrrole;4-tert-butyl-1,3-thiazole;3-tert-butylthiophene;ethane;2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;bis(5-propan-2-yl-1H-pyrazole);2-propan-2-yl-1H-pyrrole;2-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene
CID 158077807

Frequently Asked Questions

What is the IUPAC name of 5-(4-heptoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1,2,4-oxadiazole;2-(4-hexoxyphenyl)-4-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;4-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1H-pyrazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-thiazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)thiophene;5-(4-pentoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole?
The IUPAC name of 5-(4-heptoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1,2,4-oxadiazole;2-(4-hexoxyphenyl)-4-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;4-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1H-pyrazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-thiazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)thiophene;5-(4-pentoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole (CID 158567642) is 5-(4-heptoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1,2,4-oxadiazole;2-(4-hexoxyphenyl)-4-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;4-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1H-pyrazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-thiazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)thiophene;5-(4-pentoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole.
What is the SMILES notation for 5-(4-heptoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1,2,4-oxadiazole;2-(4-hexoxyphenyl)-4-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;4-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1H-pyrazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-thiazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)thiophene;5-(4-pentoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole?
The canonical SMILES for 5-(4-heptoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1,2,4-oxadiazole;2-(4-hexoxyphenyl)-4-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;4-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1H-pyrazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-thiazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)thiophene;5-(4-pentoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole is C=C(C)c1ccc(-c2cc(-c3ccc(OCCCCCC)cc3)n[nH]2)cc1.C=C(C)c1ccc(-c2cc(-c3ccc(OCCCCCC)cc3)on2)cc1.C=C(C)c1ccc(-c2cc(-c3ccc(OCCCCCCC)cc3)on2)cc1.C=C(C)c1ccc(-c2ccc(-c3ccc(OCCCCCC)cc3)cn2)cc1.C=C(C)c1ccc(-c2ccc(-c3ccc(OCCCCCC)cc3)nc2)cc1.C=C(C)c1ccc(-c2ccc(-c3ccc(OCCCCCC)cc3)s2)cc1.C=C(C)c1ccc(-c2coc(-c3ccc(OCCCCCC)cc3)n2)cc1.C=C(C)c1ccc(-c2nc(-c3ccc(OCCCCCC)cc3)co2)cc1.C=C(C)c1ccc(-c2nc(-c3ccc(OCCCCCC)cc3)no2)cc1.C=C(C)c1ccc(-c2ncc(-c3ccc(OCCCCC)cc3)o2)cc1.C=C(C)c1ccc(-c2ncc(-c3ccc(OCCCCCC)cc3)o2)cc1.C=C(C)c1ccc(-c2ncc(-c3ccc(OCCCCCC)cc3)s2)cc1.
What is the InChIKey of 5-(4-heptoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1,2,4-oxadiazole;2-(4-hexoxyphenyl)-4-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;4-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1H-pyrazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-thiazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)thiophene;5-(4-pentoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole?
The InChIKey is HRRISMYHQVWCKT-UHFFFAOYSA-N. The full InChI is InChI=1S/2C26H29NO.C25H29NO2.C25H28OS.C24H28N2O.4C24H27NO2.C24H27NOS.C23H26N2O2.C23H25NO2/c1-4-5-6-7-18-28-25-15-12-22(13-16-25)24-14-17-26(27-19-24)23-10-8-21(9-11-23)20(2)3;1-4-5-6-7-18-28-25-15-12-23(13-16-25)26-17-14-24(19-27-26)22-10-8-21(9-11-22)20(2)3;1-4-5-6-7-8-17-27-23-15-13-22(14-16-23)25-18-24(26-28-25)21-11-9-20(10-12-21)19(2)3;1-4-5-6-7-18-26-23-14-12-22(13-15-23)25-17-16-24(27-25)21-10-8-20(9-11-21)19(2)3;1-4-5-6-7-16-27-22-14-12-21(13-15-22)24-17-23(25-26-24)20-10-8-19(9-11-20)18(2)3;1-4-5-6-7-16-26-22-14-12-20(13-15-22)23-17-27-24(25-23)21-10-8-19(9-11-21)18(2)3;1-4-5-6-7-16-26-22-14-12-20(13-15-22)23-17-25-24(27-23)21-10-8-19(9-11-21)18(2)3;1-4-5-6-7-16-26-22-14-12-21(13-15-22)24-25-23(17-27-24)20-10-8-19(9-11-20)18(2)3;1-4-5-6-7-16-26-22-14-12-21(13-15-22)24-17-23(25-27-24)20-10-8-19(9-11-20)18(2)3;1-4-5-6-7-16-26-22-14-12-20(13-15-22)23-17-25-24(27-23)21-10-8-19(9-11-21)18(2)3;1-4-5-6-7-16-26-21-14-12-19(13-15-21)22-24-23(27-25-22)20-10-8-18(9-11-20)17(2)3;1-4-5-6-15-25-21-13-11-19(12-14-21)22-16-24-23(26-22)20-9-7-18(8-10-20)17(2)3/h2*8-17,19H,2,4-7,18H2,1,3H3;9-16,18H,2,4-8,17H2,1,3H3;8-17H,2,4-7,18H2,1,3H3;8-15,17H,2,4-7,16H2,1,3H3,(H,25,26);5*8-15,17H,2,4-7,16H2,1,3H3;8-15H,2,4-7,16H2,1,3H3;7-14,16H,2,4-6,15H2,1,3H3.
What are the key properties of 5-(4-heptoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1,2,4-oxadiazole;2-(4-hexoxyphenyl)-4-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;4-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1H-pyrazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-thiazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)thiophene;5-(4-pentoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole?
5-(4-heptoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1,2,4-oxadiazole;2-(4-hexoxyphenyl)-4-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;4-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1H-pyrazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-thiazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)thiophene;5-(4-pentoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole has a molecular weight of 4389.05 g/mol, XLogP of 85.50, 108 rotatable bonds, 1 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-heptoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1,2,4-oxadiazole;2-(4-hexoxyphenyl)-4-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;4-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole;5-(4-hexoxyphenyl)-3-(4-prop-1-en-2-ylphenyl)-1,2-oxazole;3-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)-1H-pyrazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)pyridine;5-(4-hexoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-thiazole;2-(4-hexoxyphenyl)-5-(4-prop-1-en-2-ylphenyl)thiophene;5-(4-pentoxyphenyl)-2-(4-prop-1-en-2-ylphenyl)-1,3-oxazole is sourced from PubChem (CID 158567642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).