1-[4-[3-cyano-1-(cyclopropylmethyl)-6-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]-3-propan-2-ylurea;propan-2-yl N-[4-[1-cyclobutyl-3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate

C243H272N30O39 — CID 159840434

IUPAC1-[4-[3-cyano-1-(cyclopropylmethyl)-6-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]-3-propan-2-ylurea;propan-2-yl N-[4-[1-cyclobutyl-3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate
SMILESCC(C)NC(=O)Nc1ccc(-c2c(C#N)c3ccc(OC4COCOC4)cc3n2CC2CC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(-c3ccno3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(-c3ccon3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(-c3nc(C4CC4)no3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(-c3nnc(C4CC4)o3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(-c3noc(C4CC4)n3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.Cc1nc(-c2c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c3cc(OC4CCOCC4)ccc23)no1.Cc1noc(-c2c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c3cc(OC4CCOCC4)ccc23)n1
InChIInChI=1S/3C32H36N4O5.2C30H34N4O5.2C30H33N3O5.C27H30N4O4/c1-19(2)39-32(37)33-22-10-8-20(9-11-22)29-28(30-34-31(41-35-30)21-6-7-21)26-13-12-25(40-24-14-16-38-17-15-24)18-27(26)36(29)23-4-3-5-23;1-19(2)39-32(37)33-22-10-8-20(9-11-22)29-28(31-35-34-30(41-31)21-6-7-21)26-13-12-25(40-24-14-16-38-17-15-24)18-27(26)36(29)23-4-3-5-23;1-19(2)39-32(37)33-22-10-8-20(9-11-22)29-28(31-34-30(35-41-31)21-6-7-21)26-13-12-25(40-24-14-16-38-17-15-24)18-27(26)36(29)23-4-3-5-23;1-18(2)37-30(35)32-21-9-7-20(8-10-21)28-27(29-31-19(3)39-33-29)25-12-11-24(38-23-13-15-36-16-14-23)17-26(25)34(28)22-5-4-6-22;1-18(2)37-30(35)32-21-9-7-20(8-10-21)28-27(29-31-19(3)33-39-29)25-12-11-24(38-23-13-15-36-16-14-23)17-26(25)34(28)22-5-4-6-22;1-19(2)36-30(34)32-21-8-6-20(7-9-21)29-28(27-12-15-31-38-27)25-11-10-24(37-23-13-16-35-17-14-23)18-26(25)33(29)22-4-3-5-22;1-19(2)37-30(34)31-21-8-6-20(7-9-21)29-28(26-14-17-36-32-26)25-11-10-24(38-23-12-15-35-16-13-23)18-27(25)33(29)22-4-3-5-22;1-17(2)29-27(32)30-20-7-5-19(6-8-20)26-24(12-28)23-10-9-21(35-22-14-33-16-34-15-22)11-25(23)31(26)13-18-3-4-18/h3*8-13,18-19,21,23-24H,3-7,14-17H2,1-2H3,(H,33,37);2*7-12,17-18,22-23H,4-6,13-16H2,1-3H3,(H,32,35);6-12,15,18-19,22-23H,3-5,13-14,16-17H2,1-2H3,(H,32,34);6-11,14,17-19,22-23H,3-5,12-13,15-16H2,1-2H3,(H,31,34);5-11,17-18,22H,3-4,13-16H2,1-2H3,(H2,29,30,32)
InChIKeyNOPKLVILGXFXFZ-UHFFFAOYSA-N
MW4237.02 g/mol
LogP55.52
Rot. Bonds59

About 1-[4-[3-cyano-1-(cyclopropylmethyl)-6-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]-3-propan-2-ylurea;propan-2-yl N-[4-[1-cyclobutyl-3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate

1-[4-[3-cyano-1-(cyclopropylmethyl)-6-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]-3-propan-2-ylurea;propan-2-yl N-[4-[1-cyclobutyl-3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate (PubChem CID 159840434) has the molecular formula C243H272N30O39 and a molecular weight of 4237.02 g/mol. Its IUPAC name is 1-[4-[3-cyano-1-(cyclopropylmethyl)-6-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]-3-propan-2-ylurea;propan-2-yl N-[4-[1-cyclobutyl-3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate.

Molecular Properties

Compound Name1-[4-[3-cyano-1-(cyclopropylmethyl)-6-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]-3-propan-2-ylurea;propan-2-yl N-[4-[1-cyclobutyl-3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate
PubChem CID159840434
Molecular FormulaC243H272N30O39
Molecular Weight4237.02 g/mol
Exact Mass4234.02
IUPAC Name1-[4-[3-cyano-1-(cyclopropylmethyl)-6-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]-3-propan-2-ylurea;propan-2-yl N-[4-[1-cyclobutyl-3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate
SMILESCC(C)NC(=O)Nc1ccc(-c2c(C#N)c3ccc(OC4COCOC4)cc3n2CC2CC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(-c3ccno3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(-c3ccon3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(-c3nc(C4CC4)no3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(-c3nnc(C4CC4)o3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(-c3noc(C4CC4)n3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.Cc1nc(-c2c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c3cc(OC4CCOCC4)ccc23)no1.Cc1noc(-c2c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c3cc(OC4CCOCC4)ccc23)n1
InChIInChI=1S/3C32H36N4O5.2C30H34N4O5.2C30H33N3O5.C27H30N4O4/c1-19(2)39-32(37)33-22-10-8-20(9-11-22)29-28(30-34-31(41-35-30)21-6-7-21)26-13-12-25(40-24-14-16-38-17-15-24)18-27(26)36(29)23-4-3-5-23;1-19(2)39-32(37)33-22-10-8-20(9-11-22)29-28(31-35-34-30(41-31)21-6-7-21)26-13-12-25(40-24-14-16-38-17-15-24)18-27(26)36(29)23-4-3-5-23;1-19(2)39-32(37)33-22-10-8-20(9-11-22)29-28(31-34-30(35-41-31)21-6-7-21)26-13-12-25(40-24-14-16-38-17-15-24)18-27(26)36(29)23-4-3-5-23;1-18(2)37-30(35)32-21-9-7-20(8-10-21)28-27(29-31-19(3)39-33-29)25-12-11-24(38-23-13-15-36-16-14-23)17-26(25)34(28)22-5-4-6-22;1-18(2)37-30(35)32-21-9-7-20(8-10-21)28-27(29-31-19(3)33-39-29)25-12-11-24(38-23-13-15-36-16-14-23)17-26(25)34(28)22-5-4-6-22;1-19(2)36-30(34)32-21-8-6-20(7-9-21)29-28(27-12-15-31-38-27)25-11-10-24(37-23-13-16-35-17-14-23)18-26(25)33(29)22-4-3-5-22;1-19(2)37-30(34)31-21-8-6-20(7-9-21)29-28(26-14-17-36-32-26)25-11-10-24(38-23-12-15-35-16-13-23)18-27(25)33(29)22-4-3-5-22;1-17(2)29-27(32)30-20-7-5-19(6-8-20)26-24(12-28)23-10-9-21(35-22-14-33-16-34-15-22)11-25(23)31(26)13-18-3-4-18/h3*8-13,18-19,21,23-24H,3-7,14-17H2,1-2H3,(H,33,37);2*7-12,17-18,22-23H,4-6,13-16H2,1-3H3,(H,32,35);6-12,15,18-19,22-23H,3-5,13-14,16-17H2,1-2H3,(H,32,34);6-11,14,17-19,22-23H,3-5,12-13,15-16H2,1-2H3,(H,31,34);5-11,17-18,22H,3-4,13-16H2,1-2H3,(H2,29,30,32)
InChIKeyNOPKLVILGXFXFZ-UHFFFAOYSA-N
XLogP55.52
TPSA776.24 Ų
H-Bond Donors9
H-Bond Acceptors60
Rotatable Bonds59
Heavy Atoms312
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004237.02
LogP ≤ 555.52
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1060

Analyze 1-[4-[3-cyano-1-(cyclopropylmethyl)-6-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]-3-propan-2-ylurea;propan-2-yl N-[4-[1-cyclobutyl-3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate with MolForge

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Related Compounds

2-(4-aminophenyl)-1-ethyl-6-methoxyindole-3-carbonitrile;ethyl N-(3-cyano-1-ethyl-6-nitroindol-2-yl)carbamate;2-ethyl-5-(1-ethyl-6-methoxyindol-3-yl)-1,3,4-oxadiazole;3-(1-ethyl-6-methoxyindol-3-yl)-1,2-oxazole;5-(1-ethyl-6-methoxyindol-3-yl)-1,2-oxazole;1-ethyl-6-methoxy-2-[4-(trifluoromethoxy)phenyl]indole-3-carbonitrile
CID 159770717
1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4-methyl-1,2-oxazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-3-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)indol-2-yl]phenyl]carbamate
CID 157089002
propan-2-yl N-[4-[6-(2-amino-2-oxoethoxy)-3-cyano-1-cyclobutylindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-[2-(cyclopropylamino)-2-oxoethoxy]indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(morpholine-4-carbonyl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(pyrrolidine-1-carbonyl)indol-2-yl]phenyl]carbamate
CID 157462511
1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1H-imidazol-2-ylmethoxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,2-oxazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate
CID 157782222
1-Cyclobutyl-3-[4-[1-cyclobutyl-3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-ethoxyindol-2-yl]phenyl]urea;1-cyclobutyl-3-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-6-ethoxyindol-2-yl]phenyl]urea;1-cyclobutyl-3-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-6-ethoxyindol-2-yl]phenyl]urea;1-cyclobutyl-3-[4-[1-cyclobutyl-6-ethoxy-3-(3-methyl-1,2,4-oxadiazol-5-yl)indol-2-yl]phenyl]urea;1-cyclobutyl-3-[4-[1-cyclobutyl-6-ethoxy-3-(5-methyl-1,2,4-oxadiazol-3-yl)indol-2-yl]phenyl]urea
CID 158081047
1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(5-methyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate
CID 158114769
CID 158165111
CID 158165111
propan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate
CID 158422758
CID 158561847
CID 158561847
1-cyclopropylethyl N-[4-(3-acetyl-1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(5-methyl-1,2,4-oxadiazol-3-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(5-methyl-1,3,4-oxadiazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-(1-cyclobutyl-6-ethoxy-3-nitroindol-2-yl)phenyl]carbamate
CID 158729947
CID 158834326
CID 158834326
1-[4-(3-cyano-1-cyclobutyl-6-cyclopropyloxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1,3-dioxolan-2-ylmethoxy)indol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]carbamate;1-[4-[1-(cyclopropylmethyl)-6-ethoxy-3-formylindol-2-yl]phenyl]-3-propan-2-ylurea;propan-2-yl N-[4-[1-(cyclopropylmethyl)-6-ethoxy-3-formylindol-2-yl]phenyl]carbamate
CID 158915489

Frequently Asked Questions

What is the IUPAC name of 1-[4-[3-cyano-1-(cyclopropylmethyl)-6-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]-3-propan-2-ylurea;propan-2-yl N-[4-[1-cyclobutyl-3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate?
The IUPAC name of 1-[4-[3-cyano-1-(cyclopropylmethyl)-6-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]-3-propan-2-ylurea;propan-2-yl N-[4-[1-cyclobutyl-3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate (CID 159840434) is 1-[4-[3-cyano-1-(cyclopropylmethyl)-6-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]-3-propan-2-ylurea;propan-2-yl N-[4-[1-cyclobutyl-3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate.
What is the SMILES notation for 1-[4-[3-cyano-1-(cyclopropylmethyl)-6-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]-3-propan-2-ylurea;propan-2-yl N-[4-[1-cyclobutyl-3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate?
The canonical SMILES for 1-[4-[3-cyano-1-(cyclopropylmethyl)-6-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]-3-propan-2-ylurea;propan-2-yl N-[4-[1-cyclobutyl-3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate is CC(C)NC(=O)Nc1ccc(-c2c(C#N)c3ccc(OC4COCOC4)cc3n2CC2CC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(-c3ccno3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(-c3ccon3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(-c3nc(C4CC4)no3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(-c3nnc(C4CC4)o3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(-c3noc(C4CC4)n3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.Cc1nc(-c2c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c3cc(OC4CCOCC4)ccc23)no1.Cc1noc(-c2c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c3cc(OC4CCOCC4)ccc23)n1.
What is the InChIKey of 1-[4-[3-cyano-1-(cyclopropylmethyl)-6-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]-3-propan-2-ylurea;propan-2-yl N-[4-[1-cyclobutyl-3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate?
The InChIKey is NOPKLVILGXFXFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/3C32H36N4O5.2C30H34N4O5.2C30H33N3O5.C27H30N4O4/c1-19(2)39-32(37)33-22-10-8-20(9-11-22)29-28(30-34-31(41-35-30)21-6-7-21)26-13-12-25(40-24-14-16-38-17-15-24)18-27(26)36(29)23-4-3-5-23;1-19(2)39-32(37)33-22-10-8-20(9-11-22)29-28(31-35-34-30(41-31)21-6-7-21)26-13-12-25(40-24-14-16-38-17-15-24)18-27(26)36(29)23-4-3-5-23;1-19(2)39-32(37)33-22-10-8-20(9-11-22)29-28(31-34-30(35-41-31)21-6-7-21)26-13-12-25(40-24-14-16-38-17-15-24)18-27(26)36(29)23-4-3-5-23;1-18(2)37-30(35)32-21-9-7-20(8-10-21)28-27(29-31-19(3)39-33-29)25-12-11-24(38-23-13-15-36-16-14-23)17-26(25)34(28)22-5-4-6-22;1-18(2)37-30(35)32-21-9-7-20(8-10-21)28-27(29-31-19(3)33-39-29)25-12-11-24(38-23-13-15-36-16-14-23)17-26(25)34(28)22-5-4-6-22;1-19(2)36-30(34)32-21-8-6-20(7-9-21)29-28(27-12-15-31-38-27)25-11-10-24(37-23-13-16-35-17-14-23)18-26(25)33(29)22-4-3-5-22;1-19(2)37-30(34)31-21-8-6-20(7-9-21)29-28(26-14-17-36-32-26)25-11-10-24(38-23-12-15-35-16-13-23)18-27(25)33(29)22-4-3-5-22;1-17(2)29-27(32)30-20-7-5-19(6-8-20)26-24(12-28)23-10-9-21(35-22-14-33-16-34-15-22)11-25(23)31(26)13-18-3-4-18/h3*8-13,18-19,21,23-24H,3-7,14-17H2,1-2H3,(H,33,37);2*7-12,17-18,22-23H,4-6,13-16H2,1-3H3,(H,32,35);6-12,15,18-19,22-23H,3-5,13-14,16-17H2,1-2H3,(H,32,34);6-11,14,17-19,22-23H,3-5,12-13,15-16H2,1-2H3,(H,31,34);5-11,17-18,22H,3-4,13-16H2,1-2H3,(H2,29,30,32).
What are the key properties of 1-[4-[3-cyano-1-(cyclopropylmethyl)-6-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]-3-propan-2-ylurea;propan-2-yl N-[4-[1-cyclobutyl-3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate?
1-[4-[3-cyano-1-(cyclopropylmethyl)-6-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]-3-propan-2-ylurea;propan-2-yl N-[4-[1-cyclobutyl-3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate has a molecular weight of 4237.02 g/mol, XLogP of 55.52, 59 rotatable bonds, 9 hydrogen bond donors, and 60 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[3-cyano-1-(cyclopropylmethyl)-6-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]-3-propan-2-ylurea;propan-2-yl N-[4-[1-cyclobutyl-3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,2,4-oxadiazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate is sourced from PubChem (CID 159840434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).