1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxolan-3-yloxy)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfanyl)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfinyl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]indol-2-yl]phenyl]carbamate

C186H189F5N22O22S3 — CID 159921671

IUPAC1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxolan-3-yloxy)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfanyl)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfinyl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]indol-2-yl]phenyl]carbamate
SMILESCC(C)OC(=O)Nc1ccc(-c2c(-c3cocn3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(-c3nc(C(F)(F)F)cs3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(OC(=O)Nc1ccc(-c2c(C#N)c3ccc(OC4CCOC4)cc3n2CC2CC2)cc1)C1CC1.CC(OC(=O)Nc1ccc(-c2c(C#N)c3ccc(OC4CCOCC4)cc3n2CC2CC2)cc1)C1CC1.CC(OC(=O)Nc1ccc(-c2c(C#N)c3ccc(S(=O)CCn4ccnc4)cc3n2C2CCC2)cc1)c1ccc(F)cc1.CC(OC(=O)Nc1ccc(-c2c(C#N)c3ccc(SCCn4ccnc4)cc3n2C2CCC2)cc1)c1ccc(F)cc1
InChIInChI=1S/C33H30FN5O3S.C33H30FN5O2S.C31H32F3N3O4S.C30H33N3O5.C30H33N3O4.C29H31N3O4/c1-22(23-5-9-25(34)10-6-23)42-33(40)37-26-11-7-24(8-12-26)32-30(20-35)29-14-13-28(19-31(29)39(32)27-3-2-4-27)43(41)18-17-38-16-15-36-21-38;1-22(23-5-9-25(34)10-6-23)41-33(40)37-26-11-7-24(8-12-26)32-30(20-35)29-14-13-28(42-18-17-38-16-15-36-21-38)19-31(29)39(32)27-3-2-4-27;1-18(2)40-30(38)35-20-8-6-19(7-9-20)28-27(29-36-26(17-42-29)31(32,33)34)24-11-10-23(41-22-12-14-39-15-13-22)16-25(24)37(28)21-4-3-5-21;1-19(2)37-30(34)32-21-8-6-20(7-9-21)29-28(26-17-36-18-31-26)25-11-10-24(38-23-12-14-35-15-13-23)16-27(25)33(29)22-4-3-5-22;1-19(21-4-5-21)36-30(34)32-23-8-6-22(7-9-23)29-27(17-31)26-11-10-25(37-24-12-14-35-15-13-24)16-28(26)33(29)18-20-2-3-20;1-18(20-4-5-20)35-29(33)31-22-8-6-21(7-9-22)28-26(15-30)25-11-10-23(36-24-12-13-34-17-24)14-27(25)32(28)16-19-2-3-19/h5-16,19,21-22,27H,2-4,17-18H2,1H3,(H,37,40);5-16,19,21-22,27H,2-4,17-18H2,1H3,(H,37,40);6-11,16-18,21-22H,3-5,12-15H2,1-2H3,(H,35,38);6-11,16-19,22-23H,3-5,12-15H2,1-2H3,(H,32,34);6-11,16,19-21,24H,2-5,12-15,18H2,1H3,(H,32,34);6-11,14,18-20,24H,2-5,12-13,16-17H2,1H3,(H,31,33)
InChIKeyNYMBXYATOZLFLN-UHFFFAOYSA-N
MW3275.88 g/mol
LogP44.19
Rot. Bonds48

About 1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxolan-3-yloxy)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfanyl)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfinyl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]indol-2-yl]phenyl]carbamate

1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxolan-3-yloxy)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfanyl)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfinyl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]indol-2-yl]phenyl]carbamate (PubChem CID 159921671) has the molecular formula C186H189F5N22O22S3 and a molecular weight of 3275.88 g/mol. Its IUPAC name is 1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxolan-3-yloxy)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfanyl)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfinyl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]indol-2-yl]phenyl]carbamate.

Molecular Properties

Compound Name1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxolan-3-yloxy)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfanyl)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfinyl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]indol-2-yl]phenyl]carbamate
PubChem CID159921671
Molecular FormulaC186H189F5N22O22S3
Molecular Weight3275.88 g/mol
Exact Mass3273.34
IUPAC Name1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxolan-3-yloxy)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfanyl)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfinyl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]indol-2-yl]phenyl]carbamate
SMILESCC(C)OC(=O)Nc1ccc(-c2c(-c3cocn3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(-c3nc(C(F)(F)F)cs3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(OC(=O)Nc1ccc(-c2c(C#N)c3ccc(OC4CCOC4)cc3n2CC2CC2)cc1)C1CC1.CC(OC(=O)Nc1ccc(-c2c(C#N)c3ccc(OC4CCOCC4)cc3n2CC2CC2)cc1)C1CC1.CC(OC(=O)Nc1ccc(-c2c(C#N)c3ccc(S(=O)CCn4ccnc4)cc3n2C2CCC2)cc1)c1ccc(F)cc1.CC(OC(=O)Nc1ccc(-c2c(C#N)c3ccc(SCCn4ccnc4)cc3n2C2CCC2)cc1)c1ccc(F)cc1
InChIInChI=1S/C33H30FN5O3S.C33H30FN5O2S.C31H32F3N3O4S.C30H33N3O5.C30H33N3O4.C29H31N3O4/c1-22(23-5-9-25(34)10-6-23)42-33(40)37-26-11-7-24(8-12-26)32-30(20-35)29-14-13-28(19-31(29)39(32)27-3-2-4-27)43(41)18-17-38-16-15-36-21-38;1-22(23-5-9-25(34)10-6-23)41-33(40)37-26-11-7-24(8-12-26)32-30(20-35)29-14-13-28(42-18-17-38-16-15-36-21-38)19-31(29)39(32)27-3-2-4-27;1-18(2)40-30(38)35-20-8-6-19(7-9-20)28-27(29-36-26(17-42-29)31(32,33)34)24-11-10-23(41-22-12-14-39-15-13-22)16-25(24)37(28)21-4-3-5-21;1-19(2)37-30(34)32-21-8-6-20(7-9-21)29-28(26-17-36-18-31-26)25-11-10-24(38-23-12-14-35-15-13-23)16-27(25)33(29)22-4-3-5-22;1-19(21-4-5-21)36-30(34)32-23-8-6-22(7-9-23)29-27(17-31)26-11-10-25(37-24-12-14-35-15-13-24)16-28(26)33(29)18-20-2-3-20;1-18(20-4-5-20)35-29(33)31-22-8-6-21(7-9-22)28-26(15-30)25-11-10-23(36-24-12-13-34-17-24)14-27(25)32(28)16-19-2-3-19/h5-16,19,21-22,27H,2-4,17-18H2,1H3,(H,37,40);5-16,19,21-22,27H,2-4,17-18H2,1H3,(H,37,40);6-11,16-18,21-22H,3-5,12-15H2,1-2H3,(H,35,38);6-11,16-19,22-23H,3-5,12-15H2,1-2H3,(H,32,34);6-11,16,19-21,24H,2-5,12-15,18H2,1H3,(H,32,34);6-11,14,18-20,24H,2-5,12-13,16-17H2,1H3,(H,31,33)
InChIKeyNYMBXYATOZLFLN-UHFFFAOYSA-N
XLogP44.19
TPSA520.19 Ų
H-Bond Donors6
H-Bond Acceptors40
Rotatable Bonds48
Heavy Atoms238
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003275.88
LogP ≤ 544.19
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1040

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}

Analyze 1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxolan-3-yloxy)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfanyl)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfinyl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]indol-2-yl]phenyl]carbamate with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxolan-3-yloxy)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfanyl)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfinyl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]indol-2-yl]phenyl]carbamate?
The IUPAC name of 1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxolan-3-yloxy)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfanyl)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfinyl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]indol-2-yl]phenyl]carbamate (CID 159921671) is 1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxolan-3-yloxy)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfanyl)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfinyl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]indol-2-yl]phenyl]carbamate.
What is the SMILES notation for 1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxolan-3-yloxy)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfanyl)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfinyl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]indol-2-yl]phenyl]carbamate?
The canonical SMILES for 1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxolan-3-yloxy)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfanyl)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfinyl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]indol-2-yl]phenyl]carbamate is CC(C)OC(=O)Nc1ccc(-c2c(-c3cocn3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(-c3nc(C(F)(F)F)cs3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(OC(=O)Nc1ccc(-c2c(C#N)c3ccc(OC4CCOC4)cc3n2CC2CC2)cc1)C1CC1.CC(OC(=O)Nc1ccc(-c2c(C#N)c3ccc(OC4CCOCC4)cc3n2CC2CC2)cc1)C1CC1.CC(OC(=O)Nc1ccc(-c2c(C#N)c3ccc(S(=O)CCn4ccnc4)cc3n2C2CCC2)cc1)c1ccc(F)cc1.CC(OC(=O)Nc1ccc(-c2c(C#N)c3ccc(SCCn4ccnc4)cc3n2C2CCC2)cc1)c1ccc(F)cc1.
What is the InChIKey of 1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxolan-3-yloxy)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfanyl)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfinyl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]indol-2-yl]phenyl]carbamate?
The InChIKey is NYMBXYATOZLFLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H30FN5O3S.C33H30FN5O2S.C31H32F3N3O4S.C30H33N3O5.C30H33N3O4.C29H31N3O4/c1-22(23-5-9-25(34)10-6-23)42-33(40)37-26-11-7-24(8-12-26)32-30(20-35)29-14-13-28(19-31(29)39(32)27-3-2-4-27)43(41)18-17-38-16-15-36-21-38;1-22(23-5-9-25(34)10-6-23)41-33(40)37-26-11-7-24(8-12-26)32-30(20-35)29-14-13-28(42-18-17-38-16-15-36-21-38)19-31(29)39(32)27-3-2-4-27;1-18(2)40-30(38)35-20-8-6-19(7-9-20)28-27(29-36-26(17-42-29)31(32,33)34)24-11-10-23(41-22-12-14-39-15-13-22)16-25(24)37(28)21-4-3-5-21;1-19(2)37-30(34)32-21-8-6-20(7-9-21)29-28(26-17-36-18-31-26)25-11-10-24(38-23-12-14-35-15-13-23)16-27(25)33(29)22-4-3-5-22;1-19(21-4-5-21)36-30(34)32-23-8-6-22(7-9-23)29-27(17-31)26-11-10-25(37-24-12-14-35-15-13-24)16-28(26)33(29)18-20-2-3-20;1-18(20-4-5-20)35-29(33)31-22-8-6-21(7-9-22)28-26(15-30)25-11-10-23(36-24-12-13-34-17-24)14-27(25)32(28)16-19-2-3-19/h5-16,19,21-22,27H,2-4,17-18H2,1H3,(H,37,40);5-16,19,21-22,27H,2-4,17-18H2,1H3,(H,37,40);6-11,16-18,21-22H,3-5,12-15H2,1-2H3,(H,35,38);6-11,16-19,22-23H,3-5,12-15H2,1-2H3,(H,32,34);6-11,16,19-21,24H,2-5,12-15,18H2,1H3,(H,32,34);6-11,14,18-20,24H,2-5,12-13,16-17H2,1H3,(H,31,33).
What are the key properties of 1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxolan-3-yloxy)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfanyl)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfinyl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]indol-2-yl]phenyl]carbamate?
1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxolan-3-yloxy)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfanyl)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfinyl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]indol-2-yl]phenyl]carbamate has a molecular weight of 3275.88 g/mol, XLogP of 44.19, 48 rotatable bonds, 6 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(oxolan-3-yloxy)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfanyl)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(2-imidazol-1-ylethylsulfinyl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1,3-oxazol-4-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]indol-2-yl]phenyl]carbamate is sourced from PubChem (CID 159921671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).