4,5-bis(2-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;4,5-bis(3-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;3-[5-(3-hydroxyphenyl)-2-[2-(1H-indol-3-yl)ethyl]-1,3-oxazol-4-yl]phenol;3-[5-(3-hydroxyphenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazol-4-yl]phenol;2-[3-(1H-indol-3-yl)propyl]-4,5-bis(3-methylphenyl)-1,3-oxazole;2-[3-(1H-indol-3-yl)propyl]-4,5-bis[2-(trifluoromethyl)phenyl]-1,3-oxazole

C159H128F10N12O10 — CID 161020231

IUPAC4,5-bis(2-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;4,5-bis(3-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;3-[5-(3-hydroxyphenyl)-2-[2-(1H-indol-3-yl)ethyl]-1,3-oxazol-4-yl]phenol;3-[5-(3-hydroxyphenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazol-4-yl]phenol;2-[3-(1H-indol-3-yl)propyl]-4,5-bis(3-methylphenyl)-1,3-oxazole;2-[3-(1H-indol-3-yl)propyl]-4,5-bis[2-(trifluoromethyl)phenyl]-1,3-oxazole
SMILESCc1cccc(-c2nc(CCCc3c[nH]c4ccccc34)oc2-c2cccc(C)c2)c1.FC(F)(F)c1ccccc1-c1nc(CCCc2c[nH]c3ccccc23)oc1-c1ccccc1C(F)(F)F.Fc1cccc(-c2nc(CCCc3c[nH]c4ccccc34)oc2-c2cccc(F)c2)c1.Fc1ccccc1-c1nc(CCCc2c[nH]c3ccccc23)oc1-c1ccccc1F.Oc1cccc(-c2nc(CCCc3c[nH]c4ccccc34)oc2-c2cccc(O)c2)c1.Oc1cccc(-c2nc(CCc3c[nH]c4ccccc34)oc2-c2cccc(O)c2)c1
InChIInChI=1S/C28H20F6N2O.C28H26N2O.2C26H20F2N2O.C26H22N2O3.C25H20N2O3/c29-27(30,31)21-12-4-1-10-19(21)25-26(20-11-2-5-13-22(20)28(32,33)34)37-24(36-25)15-7-8-17-16-35-23-14-6-3-9-18(17)23;1-19-8-5-10-21(16-19)27-28(22-11-6-9-20(2)17-22)31-26(30-27)15-7-12-23-18-29-25-14-4-3-13-24(23)25;27-21-12-4-1-10-19(21)25-26(20-11-2-5-13-22(20)28)31-24(30-25)15-7-8-17-16-29-23-14-6-3-9-18(17)23;27-20-9-3-6-17(14-20)25-26(18-7-4-10-21(28)15-18)31-24(30-25)13-5-8-19-16-29-23-12-2-1-11-22(19)23;29-20-9-3-6-17(14-20)25-26(18-7-4-10-21(30)15-18)31-24(28-25)13-5-8-19-16-27-23-12-2-1-11-22(19)23;28-19-7-3-5-16(13-19)24-25(17-6-4-8-20(29)14-17)30-23(27-24)12-11-18-15-26-22-10-2-1-9-21(18)22/h1-6,9-14,16,35H,7-8,15H2;3-6,8-11,13-14,16-18,29H,7,12,15H2,1-2H3;1-6,9-14,16,29H,7-8,15H2;1-4,6-7,9-12,14-16,29H,5,8,13H2;1-4,6-7,9-12,14-16,27,29-30H,5,8,13H2;1-10,13-15,26,28-29H,11-12H2
InChIKeyTYGPBTYASIYJAS-UHFFFAOYSA-N
MW2556.83 g/mol
LogP41.63
Rot. Bonds35

About 4,5-bis(2-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;4,5-bis(3-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;3-[5-(3-hydroxyphenyl)-2-[2-(1H-indol-3-yl)ethyl]-1,3-oxazol-4-yl]phenol;3-[5-(3-hydroxyphenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazol-4-yl]phenol;2-[3-(1H-indol-3-yl)propyl]-4,5-bis(3-methylphenyl)-1,3-oxazole;2-[3-(1H-indol-3-yl)propyl]-4,5-bis[2-(trifluoromethyl)phenyl]-1,3-oxazole

4,5-bis(2-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;4,5-bis(3-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;3-[5-(3-hydroxyphenyl)-2-[2-(1H-indol-3-yl)ethyl]-1,3-oxazol-4-yl]phenol;3-[5-(3-hydroxyphenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazol-4-yl]phenol;2-[3-(1H-indol-3-yl)propyl]-4,5-bis(3-methylphenyl)-1,3-oxazole;2-[3-(1H-indol-3-yl)propyl]-4,5-bis[2-(trifluoromethyl)phenyl]-1,3-oxazole (PubChem CID 161020231) has the molecular formula C159H128F10N12O10 and a molecular weight of 2556.83 g/mol. Its IUPAC name is 4,5-bis(2-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;4,5-bis(3-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;3-[5-(3-hydroxyphenyl)-2-[2-(1H-indol-3-yl)ethyl]-1,3-oxazol-4-yl]phenol;3-[5-(3-hydroxyphenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazol-4-yl]phenol;2-[3-(1H-indol-3-yl)propyl]-4,5-bis(3-methylphenyl)-1,3-oxazole;2-[3-(1H-indol-3-yl)propyl]-4,5-bis[2-(trifluoromethyl)phenyl]-1,3-oxazole.

Molecular Properties

Compound Name4,5-bis(2-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;4,5-bis(3-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;3-[5-(3-hydroxyphenyl)-2-[2-(1H-indol-3-yl)ethyl]-1,3-oxazol-4-yl]phenol;3-[5-(3-hydroxyphenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazol-4-yl]phenol;2-[3-(1H-indol-3-yl)propyl]-4,5-bis(3-methylphenyl)-1,3-oxazole;2-[3-(1H-indol-3-yl)propyl]-4,5-bis[2-(trifluoromethyl)phenyl]-1,3-oxazole
PubChem CID161020231
Molecular FormulaC159H128F10N12O10
Molecular Weight2556.83 g/mol
Exact Mass2554.97
IUPAC Name4,5-bis(2-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;4,5-bis(3-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;3-[5-(3-hydroxyphenyl)-2-[2-(1H-indol-3-yl)ethyl]-1,3-oxazol-4-yl]phenol;3-[5-(3-hydroxyphenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazol-4-yl]phenol;2-[3-(1H-indol-3-yl)propyl]-4,5-bis(3-methylphenyl)-1,3-oxazole;2-[3-(1H-indol-3-yl)propyl]-4,5-bis[2-(trifluoromethyl)phenyl]-1,3-oxazole
SMILESCc1cccc(-c2nc(CCCc3c[nH]c4ccccc34)oc2-c2cccc(C)c2)c1.FC(F)(F)c1ccccc1-c1nc(CCCc2c[nH]c3ccccc23)oc1-c1ccccc1C(F)(F)F.Fc1cccc(-c2nc(CCCc3c[nH]c4ccccc34)oc2-c2cccc(F)c2)c1.Fc1ccccc1-c1nc(CCCc2c[nH]c3ccccc23)oc1-c1ccccc1F.Oc1cccc(-c2nc(CCCc3c[nH]c4ccccc34)oc2-c2cccc(O)c2)c1.Oc1cccc(-c2nc(CCc3c[nH]c4ccccc34)oc2-c2cccc(O)c2)c1
InChIInChI=1S/C28H20F6N2O.C28H26N2O.2C26H20F2N2O.C26H22N2O3.C25H20N2O3/c29-27(30,31)21-12-4-1-10-19(21)25-26(20-11-2-5-13-22(20)28(32,33)34)37-24(36-25)15-7-8-17-16-35-23-14-6-3-9-18(17)23;1-19-8-5-10-21(16-19)27-28(22-11-6-9-20(2)17-22)31-26(30-27)15-7-12-23-18-29-25-14-4-3-13-24(23)25;27-21-12-4-1-10-19(21)25-26(20-11-2-5-13-22(20)28)31-24(30-25)15-7-8-17-16-29-23-14-6-3-9-18(17)23;27-20-9-3-6-17(14-20)25-26(18-7-4-10-21(28)15-18)31-24(30-25)13-5-8-19-16-29-23-12-2-1-11-22(19)23;29-20-9-3-6-17(14-20)25-26(18-7-4-10-21(30)15-18)31-24(28-25)13-5-8-19-16-27-23-12-2-1-11-22(19)23;28-19-7-3-5-16(13-19)24-25(17-6-4-8-20(29)14-17)30-23(27-24)12-11-18-15-26-22-10-2-1-9-21(18)22/h1-6,9-14,16,35H,7-8,15H2;3-6,8-11,13-14,16-18,29H,7,12,15H2,1-2H3;1-6,9-14,16,29H,7-8,15H2;1-4,6-7,9-12,14-16,29H,5,8,13H2;1-4,6-7,9-12,14-16,27,29-30H,5,8,13H2;1-10,13-15,26,28-29H,11-12H2
InChIKeyTYGPBTYASIYJAS-UHFFFAOYSA-N
XLogP41.63
TPSA331.84 Ų
H-Bond Donors10
H-Bond Acceptors16
Rotatable Bonds35
Heavy Atoms191
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002556.83
LogP ≤ 541.63
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1016

Analyze 4,5-bis(2-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;4,5-bis(3-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;3-[5-(3-hydroxyphenyl)-2-[2-(1H-indol-3-yl)ethyl]-1,3-oxazol-4-yl]phenol;3-[5-(3-hydroxyphenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazol-4-yl]phenol;2-[3-(1H-indol-3-yl)propyl]-4,5-bis(3-methylphenyl)-1,3-oxazole;2-[3-(1H-indol-3-yl)propyl]-4,5-bis[2-(trifluoromethyl)phenyl]-1,3-oxazole with MolForge

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Related Compounds

2-[2-(1H-indol-3-yl)ethyl]-4,5-bis(3-methoxyphenyl)-1,3-oxazole
CID 126494895
4-[3-chloro-5-[2-fluoro-5-[4-(4-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazol-5-yl]phenyl]phenyl]-5-[3-chloro-5-[3-[2-[3-(1H-indol-3-yl)propyl]-5-(3-methoxyphenyl)-1,3-oxazol-4-yl]-5-methoxyphenyl]phenyl]-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole
CID 126495200
N-[4-[3-fluoro-5-[3-fluoro-5-[4-(3-fluorophenyl)-2-[[[2-(1H-indol-3-yl)acetyl]amino]methyl]-1,3-oxazol-5-yl]phenyl]phenyl]-5-(3-fluorophenyl)-1,3-oxazol-2-yl]-3-(1H-indol-3-yl)propanamide
CID 126495283
4,5-diphenyl-2-quinolin-3-yl-1,3-oxazole;ethane;3-[5-(3-hydroxyphenyl)-2-(1H-indol-3-ylmethyl)-1,3-oxazol-4-yl]phenol
CID 145233731
4-[5-(4-hydroxyphenyl)-2-(1H-indol-3-ylmethyl)-1,3-oxazol-4-yl]-2-[3-[2-(1H-indol-3-yl)-4-[3-(trifluoromethyl)phenyl]-1,3-oxazol-5-yl]-5-(trifluoromethyl)phenyl]phenol
CID 126495265
ethanol;tetrakis(2-(1H-indol-3-ylmethyl)-4,5-diphenyl-1,3-oxazole);methanol
CID 159445993
4-[3-(1H-indol-3-yl)propyl]-3,5-bis(trifluoromethyl)aniline
CID 158244585
4-[2-[[4,5-bis(ethenyl)-1H-pyrrol-3-yl]methyl]-4-(4-methoxyphenyl)-1,3-oxazol-5-yl]phenol;2-(1H-indol-3-yl)-4,5-bis[3-(trifluoromethyl)phenyl]-1,3-oxazole
CID 145233758
5-(1H-indol-3-ylmethyl)-3-[3-(3-methylphenyl)phenyl]-1,2,4-oxadiazole
CID 127027705
N-[2-(1H-indol-3-yl)ethyl]-2-[[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide
CID 9345766
5-(1H-indol-3-ylmethyl)-3-[6-(3-methylphenyl)-2-pyridinyl]-1,2,4-oxadiazole
CID 127028684
N-[2-(5-ethyl-1H-indol-3-yl)ethyl]-1-[3-(2-fluorophenyl)phenyl]ethanimine
CID 123794883

Frequently Asked Questions

What is the IUPAC name of 4,5-bis(2-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;4,5-bis(3-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;3-[5-(3-hydroxyphenyl)-2-[2-(1H-indol-3-yl)ethyl]-1,3-oxazol-4-yl]phenol;3-[5-(3-hydroxyphenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazol-4-yl]phenol;2-[3-(1H-indol-3-yl)propyl]-4,5-bis(3-methylphenyl)-1,3-oxazole;2-[3-(1H-indol-3-yl)propyl]-4,5-bis[2-(trifluoromethyl)phenyl]-1,3-oxazole?
The IUPAC name of 4,5-bis(2-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;4,5-bis(3-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;3-[5-(3-hydroxyphenyl)-2-[2-(1H-indol-3-yl)ethyl]-1,3-oxazol-4-yl]phenol;3-[5-(3-hydroxyphenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazol-4-yl]phenol;2-[3-(1H-indol-3-yl)propyl]-4,5-bis(3-methylphenyl)-1,3-oxazole;2-[3-(1H-indol-3-yl)propyl]-4,5-bis[2-(trifluoromethyl)phenyl]-1,3-oxazole (CID 161020231) is 4,5-bis(2-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;4,5-bis(3-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;3-[5-(3-hydroxyphenyl)-2-[2-(1H-indol-3-yl)ethyl]-1,3-oxazol-4-yl]phenol;3-[5-(3-hydroxyphenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazol-4-yl]phenol;2-[3-(1H-indol-3-yl)propyl]-4,5-bis(3-methylphenyl)-1,3-oxazole;2-[3-(1H-indol-3-yl)propyl]-4,5-bis[2-(trifluoromethyl)phenyl]-1,3-oxazole.
What is the SMILES notation for 4,5-bis(2-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;4,5-bis(3-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;3-[5-(3-hydroxyphenyl)-2-[2-(1H-indol-3-yl)ethyl]-1,3-oxazol-4-yl]phenol;3-[5-(3-hydroxyphenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazol-4-yl]phenol;2-[3-(1H-indol-3-yl)propyl]-4,5-bis(3-methylphenyl)-1,3-oxazole;2-[3-(1H-indol-3-yl)propyl]-4,5-bis[2-(trifluoromethyl)phenyl]-1,3-oxazole?
The canonical SMILES for 4,5-bis(2-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;4,5-bis(3-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;3-[5-(3-hydroxyphenyl)-2-[2-(1H-indol-3-yl)ethyl]-1,3-oxazol-4-yl]phenol;3-[5-(3-hydroxyphenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazol-4-yl]phenol;2-[3-(1H-indol-3-yl)propyl]-4,5-bis(3-methylphenyl)-1,3-oxazole;2-[3-(1H-indol-3-yl)propyl]-4,5-bis[2-(trifluoromethyl)phenyl]-1,3-oxazole is Cc1cccc(-c2nc(CCCc3c[nH]c4ccccc34)oc2-c2cccc(C)c2)c1.FC(F)(F)c1ccccc1-c1nc(CCCc2c[nH]c3ccccc23)oc1-c1ccccc1C(F)(F)F.Fc1cccc(-c2nc(CCCc3c[nH]c4ccccc34)oc2-c2cccc(F)c2)c1.Fc1ccccc1-c1nc(CCCc2c[nH]c3ccccc23)oc1-c1ccccc1F.Oc1cccc(-c2nc(CCCc3c[nH]c4ccccc34)oc2-c2cccc(O)c2)c1.Oc1cccc(-c2nc(CCc3c[nH]c4ccccc34)oc2-c2cccc(O)c2)c1.
What is the InChIKey of 4,5-bis(2-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;4,5-bis(3-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;3-[5-(3-hydroxyphenyl)-2-[2-(1H-indol-3-yl)ethyl]-1,3-oxazol-4-yl]phenol;3-[5-(3-hydroxyphenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazol-4-yl]phenol;2-[3-(1H-indol-3-yl)propyl]-4,5-bis(3-methylphenyl)-1,3-oxazole;2-[3-(1H-indol-3-yl)propyl]-4,5-bis[2-(trifluoromethyl)phenyl]-1,3-oxazole?
The InChIKey is TYGPBTYASIYJAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H20F6N2O.C28H26N2O.2C26H20F2N2O.C26H22N2O3.C25H20N2O3/c29-27(30,31)21-12-4-1-10-19(21)25-26(20-11-2-5-13-22(20)28(32,33)34)37-24(36-25)15-7-8-17-16-35-23-14-6-3-9-18(17)23;1-19-8-5-10-21(16-19)27-28(22-11-6-9-20(2)17-22)31-26(30-27)15-7-12-23-18-29-25-14-4-3-13-24(23)25;27-21-12-4-1-10-19(21)25-26(20-11-2-5-13-22(20)28)31-24(30-25)15-7-8-17-16-29-23-14-6-3-9-18(17)23;27-20-9-3-6-17(14-20)25-26(18-7-4-10-21(28)15-18)31-24(30-25)13-5-8-19-16-29-23-12-2-1-11-22(19)23;29-20-9-3-6-17(14-20)25-26(18-7-4-10-21(30)15-18)31-24(28-25)13-5-8-19-16-27-23-12-2-1-11-22(19)23;28-19-7-3-5-16(13-19)24-25(17-6-4-8-20(29)14-17)30-23(27-24)12-11-18-15-26-22-10-2-1-9-21(18)22/h1-6,9-14,16,35H,7-8,15H2;3-6,8-11,13-14,16-18,29H,7,12,15H2,1-2H3;1-6,9-14,16,29H,7-8,15H2;1-4,6-7,9-12,14-16,29H,5,8,13H2;1-4,6-7,9-12,14-16,27,29-30H,5,8,13H2;1-10,13-15,26,28-29H,11-12H2.
What are the key properties of 4,5-bis(2-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;4,5-bis(3-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;3-[5-(3-hydroxyphenyl)-2-[2-(1H-indol-3-yl)ethyl]-1,3-oxazol-4-yl]phenol;3-[5-(3-hydroxyphenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazol-4-yl]phenol;2-[3-(1H-indol-3-yl)propyl]-4,5-bis(3-methylphenyl)-1,3-oxazole;2-[3-(1H-indol-3-yl)propyl]-4,5-bis[2-(trifluoromethyl)phenyl]-1,3-oxazole?
4,5-bis(2-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;4,5-bis(3-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;3-[5-(3-hydroxyphenyl)-2-[2-(1H-indol-3-yl)ethyl]-1,3-oxazol-4-yl]phenol;3-[5-(3-hydroxyphenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazol-4-yl]phenol;2-[3-(1H-indol-3-yl)propyl]-4,5-bis(3-methylphenyl)-1,3-oxazole;2-[3-(1H-indol-3-yl)propyl]-4,5-bis[2-(trifluoromethyl)phenyl]-1,3-oxazole has a molecular weight of 2556.83 g/mol, XLogP of 41.63, 35 rotatable bonds, 10 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-bis(2-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;4,5-bis(3-fluorophenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazole;3-[5-(3-hydroxyphenyl)-2-[2-(1H-indol-3-yl)ethyl]-1,3-oxazol-4-yl]phenol;3-[5-(3-hydroxyphenyl)-2-[3-(1H-indol-3-yl)propyl]-1,3-oxazol-4-yl]phenol;2-[3-(1H-indol-3-yl)propyl]-4,5-bis(3-methylphenyl)-1,3-oxazole;2-[3-(1H-indol-3-yl)propyl]-4,5-bis[2-(trifluoromethyl)phenyl]-1,3-oxazole is sourced from PubChem (CID 161020231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).