1-cyclobutyl-3-[4-(1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]urea;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-oxazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-thiazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-[4-(trifluoromethyl)-1,3-oxazol-2-yl]indol-2-yl]phenyl]carbamate

C292H320F3N33O33S4 — CID 158963894

IUPAC1-cyclobutyl-3-[4-(1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]urea;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-oxazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-thiazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-[4-(trifluoromethyl)-1,3-oxazol-2-yl]indol-2-yl]phenyl]carbamate
SMILESCCOc1ccc2c(-c3coc(C)n3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3cocn3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3csc(C)n3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3cscn3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3nc(C(F)(F)F)co3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3nc(C)c(C)o3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3nc(C)c(C)s3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3nc(C)cs3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3nn[nH]n3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2cc(-c3ccc(NC(=O)NC4CCC4)cc3)n(C3CCC3)c2c1
InChIInChI=1S/C31H35N3O4.C31H35N3O3S.C30H30F3N3O4.C30H33N3O4.2C30H33N3O3S.C29H31N3O4.C29H31N3O3S.C27H30N6O3.C25H29N3O2/c1-5-36-25-15-16-26-27(17-25)34(24-7-6-8-24)29(28(26)30-32-18(2)19(3)37-30)22-11-13-23(14-12-22)33-31(35)38-20(4)21-9-10-21;1-5-36-25-15-16-26-27(17-25)34(24-7-6-8-24)29(28(26)30-32-18(2)20(4)38-30)22-11-13-23(14-12-22)33-31(35)37-19(3)21-9-10-21;1-3-38-22-13-14-23-24(15-22)36(21-5-4-6-21)27(26(23)28-35-25(16-39-28)30(31,32)33)19-9-11-20(12-10-19)34-29(37)40-17(2)18-7-8-18;1-4-35-24-14-15-25-27(16-24)33(23-6-5-7-23)29(28(25)26-17-36-19(3)31-26)21-10-12-22(13-11-21)32-30(34)37-18(2)20-8-9-20;1-4-35-24-14-15-25-27(16-24)33(23-6-5-7-23)29(28(25)26-17-37-19(3)31-26)21-10-12-22(13-11-21)32-30(34)36-18(2)20-8-9-20;1-4-35-24-14-15-25-26(16-24)33(23-6-5-7-23)28(27(25)29-31-18(2)17-37-29)21-10-12-22(13-11-21)32-30(34)36-19(3)20-8-9-20;1-3-35-23-13-14-24-26(15-23)32(22-5-4-6-22)28(27(24)25-16-34-17-30-25)20-9-11-21(12-10-20)31-29(33)36-18(2)19-7-8-19;1-3-34-23-13-14-24-26(15-23)32(22-5-4-6-22)28(27(24)25-16-36-17-30-25)20-9-11-21(12-10-20)31-29(33)35-18(2)19-7-8-19;1-3-35-21-13-14-22-23(15-21)33(20-5-4-6-20)25(24(22)26-29-31-32-30-26)18-9-11-19(12-10-18)28-27(34)36-16(2)17-7-8-17;1-2-30-22-14-11-18-15-23(28(24(18)16-22)21-7-4-8-21)17-9-12-20(13-10-17)27-25(29)26-19-5-3-6-19/h11-17,20-21,24H,5-10H2,1-4H3,(H,33,35);11-17,19,21,24H,5-10H2,1-4H3,(H,33,35);9-18,21H,3-8H2,1-2H3,(H,34,37);2*10-18,20,23H,4-9H2,1-3H3,(H,32,34);10-17,19-20,23H,4-9H2,1-3H3,(H,32,34);2*9-19,22H,3-8H2,1-2H3,(H,31,33);9-17,20H,3-8H2,1-2H3,(H,28,34)(H,29,30,31,32);9-16,19,21H,2-8H2,1H3,(H2,26,27,29)
InChIKeyJMYNFZFQVVYAES-UHFFFAOYSA-N
MW5005.23 g/mol
LogP76.59
Rot. Bonds78

About 1-cyclobutyl-3-[4-(1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]urea;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-oxazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-thiazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-[4-(trifluoromethyl)-1,3-oxazol-2-yl]indol-2-yl]phenyl]carbamate

1-cyclobutyl-3-[4-(1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]urea;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-oxazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-thiazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-[4-(trifluoromethyl)-1,3-oxazol-2-yl]indol-2-yl]phenyl]carbamate (PubChem CID 158963894) has the molecular formula C292H320F3N33O33S4 and a molecular weight of 5005.23 g/mol. Its IUPAC name is 1-cyclobutyl-3-[4-(1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]urea;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-oxazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-thiazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-[4-(trifluoromethyl)-1,3-oxazol-2-yl]indol-2-yl]phenyl]carbamate.

Molecular Properties

Compound Name1-cyclobutyl-3-[4-(1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]urea;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-oxazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-thiazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-[4-(trifluoromethyl)-1,3-oxazol-2-yl]indol-2-yl]phenyl]carbamate
PubChem CID158963894
Molecular FormulaC292H320F3N33O33S4
Molecular Weight5005.23 g/mol
Exact Mass5001.32
IUPAC Name1-cyclobutyl-3-[4-(1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]urea;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-oxazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-thiazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-[4-(trifluoromethyl)-1,3-oxazol-2-yl]indol-2-yl]phenyl]carbamate
SMILESCCOc1ccc2c(-c3coc(C)n3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3cocn3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3csc(C)n3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3cscn3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3nc(C(F)(F)F)co3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3nc(C)c(C)o3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3nc(C)c(C)s3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3nc(C)cs3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3nn[nH]n3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2cc(-c3ccc(NC(=O)NC4CCC4)cc3)n(C3CCC3)c2c1
InChIInChI=1S/C31H35N3O4.C31H35N3O3S.C30H30F3N3O4.C30H33N3O4.2C30H33N3O3S.C29H31N3O4.C29H31N3O3S.C27H30N6O3.C25H29N3O2/c1-5-36-25-15-16-26-27(17-25)34(24-7-6-8-24)29(28(26)30-32-18(2)19(3)37-30)22-11-13-23(14-12-22)33-31(35)38-20(4)21-9-10-21;1-5-36-25-15-16-26-27(17-25)34(24-7-6-8-24)29(28(26)30-32-18(2)20(4)38-30)22-11-13-23(14-12-22)33-31(35)37-19(3)21-9-10-21;1-3-38-22-13-14-23-24(15-22)36(21-5-4-6-21)27(26(23)28-35-25(16-39-28)30(31,32)33)19-9-11-20(12-10-19)34-29(37)40-17(2)18-7-8-18;1-4-35-24-14-15-25-27(16-24)33(23-6-5-7-23)29(28(25)26-17-36-19(3)31-26)21-10-12-22(13-11-21)32-30(34)37-18(2)20-8-9-20;1-4-35-24-14-15-25-27(16-24)33(23-6-5-7-23)29(28(25)26-17-37-19(3)31-26)21-10-12-22(13-11-21)32-30(34)36-18(2)20-8-9-20;1-4-35-24-14-15-25-26(16-24)33(23-6-5-7-23)28(27(25)29-31-18(2)17-37-29)21-10-12-22(13-11-21)32-30(34)36-19(3)20-8-9-20;1-3-35-23-13-14-24-26(15-23)32(22-5-4-6-22)28(27(24)25-16-34-17-30-25)20-9-11-21(12-10-20)31-29(33)36-18(2)19-7-8-19;1-3-34-23-13-14-24-26(15-23)32(22-5-4-6-22)28(27(24)25-16-36-17-30-25)20-9-11-21(12-10-20)31-29(33)35-18(2)19-7-8-19;1-3-35-21-13-14-22-23(15-21)33(20-5-4-6-20)25(24(22)26-29-31-32-30-26)18-9-11-19(12-10-18)28-27(34)36-16(2)17-7-8-17;1-2-30-22-14-11-18-15-23(28(24(18)16-22)21-7-4-8-21)17-9-12-20(13-10-17)27-25(29)26-19-5-3-6-19/h11-17,20-21,24H,5-10H2,1-4H3,(H,33,35);11-17,19,21,24H,5-10H2,1-4H3,(H,33,35);9-18,21H,3-8H2,1-2H3,(H,34,37);2*10-18,20,23H,4-9H2,1-3H3,(H,32,34);10-17,19-20,23H,4-9H2,1-3H3,(H,32,34);2*9-19,22H,3-8H2,1-2H3,(H,31,33);9-17,20H,3-8H2,1-2H3,(H,28,34)(H,29,30,31,32);9-16,19,21H,2-8H2,1H3,(H2,26,27,29)
InChIKeyJMYNFZFQVVYAES-UHFFFAOYSA-N
XLogP76.59
TPSA737.84 Ų
H-Bond Donors12
H-Bond Acceptors58
Rotatable Bonds78
Heavy Atoms365
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5005005.23
LogP ≤ 576.59
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1058

Analyze 1-cyclobutyl-3-[4-(1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]urea;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-oxazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-thiazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-[4-(trifluoromethyl)-1,3-oxazol-2-yl]indol-2-yl]phenyl]carbamate with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-3-[4-(1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]urea;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-oxazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-thiazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-[4-(trifluoromethyl)-1,3-oxazol-2-yl]indol-2-yl]phenyl]carbamate?
The IUPAC name of 1-cyclobutyl-3-[4-(1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]urea;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-oxazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-thiazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-[4-(trifluoromethyl)-1,3-oxazol-2-yl]indol-2-yl]phenyl]carbamate (CID 158963894) is 1-cyclobutyl-3-[4-(1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]urea;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-oxazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-thiazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-[4-(trifluoromethyl)-1,3-oxazol-2-yl]indol-2-yl]phenyl]carbamate.
What is the SMILES notation for 1-cyclobutyl-3-[4-(1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]urea;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-oxazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-thiazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-[4-(trifluoromethyl)-1,3-oxazol-2-yl]indol-2-yl]phenyl]carbamate?
The canonical SMILES for 1-cyclobutyl-3-[4-(1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]urea;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-oxazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-thiazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-[4-(trifluoromethyl)-1,3-oxazol-2-yl]indol-2-yl]phenyl]carbamate is CCOc1ccc2c(-c3coc(C)n3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3cocn3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3csc(C)n3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3cscn3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3nc(C(F)(F)F)co3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3nc(C)c(C)o3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3nc(C)c(C)s3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3nc(C)cs3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3nn[nH]n3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2cc(-c3ccc(NC(=O)NC4CCC4)cc3)n(C3CCC3)c2c1.
What is the InChIKey of 1-cyclobutyl-3-[4-(1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]urea;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-oxazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-thiazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-[4-(trifluoromethyl)-1,3-oxazol-2-yl]indol-2-yl]phenyl]carbamate?
The InChIKey is JMYNFZFQVVYAES-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H35N3O4.C31H35N3O3S.C30H30F3N3O4.C30H33N3O4.2C30H33N3O3S.C29H31N3O4.C29H31N3O3S.C27H30N6O3.C25H29N3O2/c1-5-36-25-15-16-26-27(17-25)34(24-7-6-8-24)29(28(26)30-32-18(2)19(3)37-30)22-11-13-23(14-12-22)33-31(35)38-20(4)21-9-10-21;1-5-36-25-15-16-26-27(17-25)34(24-7-6-8-24)29(28(26)30-32-18(2)20(4)38-30)22-11-13-23(14-12-22)33-31(35)37-19(3)21-9-10-21;1-3-38-22-13-14-23-24(15-22)36(21-5-4-6-21)27(26(23)28-35-25(16-39-28)30(31,32)33)19-9-11-20(12-10-19)34-29(37)40-17(2)18-7-8-18;1-4-35-24-14-15-25-27(16-24)33(23-6-5-7-23)29(28(25)26-17-36-19(3)31-26)21-10-12-22(13-11-21)32-30(34)37-18(2)20-8-9-20;1-4-35-24-14-15-25-27(16-24)33(23-6-5-7-23)29(28(25)26-17-37-19(3)31-26)21-10-12-22(13-11-21)32-30(34)36-18(2)20-8-9-20;1-4-35-24-14-15-25-26(16-24)33(23-6-5-7-23)28(27(25)29-31-18(2)17-37-29)21-10-12-22(13-11-21)32-30(34)36-19(3)20-8-9-20;1-3-35-23-13-14-24-26(15-23)32(22-5-4-6-22)28(27(24)25-16-34-17-30-25)20-9-11-21(12-10-20)31-29(33)36-18(2)19-7-8-19;1-3-34-23-13-14-24-26(15-23)32(22-5-4-6-22)28(27(24)25-16-36-17-30-25)20-9-11-21(12-10-20)31-29(33)35-18(2)19-7-8-19;1-3-35-21-13-14-22-23(15-21)33(20-5-4-6-20)25(24(22)26-29-31-32-30-26)18-9-11-19(12-10-18)28-27(34)36-16(2)17-7-8-17;1-2-30-22-14-11-18-15-23(28(24(18)16-22)21-7-4-8-21)17-9-12-20(13-10-17)27-25(29)26-19-5-3-6-19/h11-17,20-21,24H,5-10H2,1-4H3,(H,33,35);11-17,19,21,24H,5-10H2,1-4H3,(H,33,35);9-18,21H,3-8H2,1-2H3,(H,34,37);2*10-18,20,23H,4-9H2,1-3H3,(H,32,34);10-17,19-20,23H,4-9H2,1-3H3,(H,32,34);2*9-19,22H,3-8H2,1-2H3,(H,31,33);9-17,20H,3-8H2,1-2H3,(H,28,34)(H,29,30,31,32);9-16,19,21H,2-8H2,1H3,(H2,26,27,29).
What are the key properties of 1-cyclobutyl-3-[4-(1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]urea;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-oxazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-thiazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-[4-(trifluoromethyl)-1,3-oxazol-2-yl]indol-2-yl]phenyl]carbamate?
1-cyclobutyl-3-[4-(1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]urea;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-oxazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-thiazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-[4-(trifluoromethyl)-1,3-oxazol-2-yl]indol-2-yl]phenyl]carbamate has a molecular weight of 5005.23 g/mol, XLogP of 76.59, 78 rotatable bonds, 12 hydrogen bond donors, and 58 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-3-[4-(1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]urea;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-oxazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-thiazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-[4-(trifluoromethyl)-1,3-oxazol-2-yl]indol-2-yl]phenyl]carbamate is sourced from PubChem (CID 158963894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).