(5-amino-4-propan-2-yl-1,3-thiazol-2-yl)-(3H-inden-1-yl)methanone;2-(2-hydroxyethoxy)ethyl 3-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-1H-indole-6-carboxylate;3H-inden-1-yl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]methanone;methyl 2-(7-amino-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-anilino-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-(dimethylamino)-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 2-(5-nitro-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylate;propan-2-yl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-5-carboxylate;1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylic acid

C173H153F3N16O30S10 — CID 160563440

IUPAC(5-amino-4-propan-2-yl-1,3-thiazol-2-yl)-(3H-inden-1-yl)methanone;2-(2-hydroxyethoxy)ethyl 3-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-1H-indole-6-carboxylate;3H-inden-1-yl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]methanone;methyl 2-(7-amino-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-anilino-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-(dimethylamino)-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 2-(5-nitro-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylate;propan-2-yl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-5-carboxylate;1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylic acid
SMILESCC(C)OC(=O)c1ccc2c(c1)CC=C2C(=O)c1nc(C(C)C)cs1.CC(C)c1csc(C(=O)C2=CCc3c(C(=O)O)cccc32)n1.CC(C)c1csc(C(=O)c2c[nH]c3cc(C(=O)OCCOCCO)ccc23)n1.CC(C)c1nc(C(=O)C2=CCc3ccccc32)sc1N.COC(=O)c1cccc2c1CC=C2C(=O)c1nc(C(C)C)cs1.COC(=O)c1csc(C(=O)C2=CCc3cc([N+](=O)[O-])ccc32)n1.COC(=O)c1csc(C(=O)C2=CCc3cccc(N)c32)n1.COC(=O)c1nc(C(=O)C2=CCc3ccccc32)sc1N(C)C.COC(=O)c1nc(C(=O)C2=CCc3ccccc32)sc1Nc1ccccc1.O=C(C1=CCc2ccccc21)c1nc(C(F)(F)F)cs1
InChIInChI=1S/C21H16N2O3S.C20H22N2O5S.C20H21NO3S.C18H17NO3S.C17H16N2O3S.C17H15NO3S.C16H16N2OS.C15H10N2O5S.C15H12N2O3S.C14H8F3NOS/c1-26-21(25)17-19(22-14-8-3-2-4-9-14)27-20(23-17)18(24)16-12-11-13-7-5-6-10-15(13)16;1-12(2)17-11-28-19(22-17)18(24)15-10-21-16-9-13(3-4-14(15)16)20(25)27-8-7-26-6-5-23;1-11(2)17-10-25-19(21-17)18(22)16-8-5-13-9-14(6-7-15(13)16)20(23)24-12(3)4;1-10(2)15-9-23-17(19-15)16(20)13-8-7-12-11(13)5-4-6-14(12)18(21)22-3;1-19(2)16-13(17(21)22-3)18-15(23-16)14(20)12-9-8-10-6-4-5-7-11(10)12;1-9(2)14-8-22-16(18-14)15(19)12-7-6-11-10(12)4-3-5-13(11)17(20)21;1-9(2)13-15(17)20-16(18-13)14(19)12-8-7-10-5-3-4-6-11(10)12;1-22-15(19)12-7-23-14(16-12)13(18)11-4-2-8-6-9(17(20)21)3-5-10(8)11;1-20-15(19)11-7-21-14(17-11)13(18)9-6-5-8-3-2-4-10(16)12(8)9;15-14(16,17)11-7-20-13(18-11)12(19)10-6-5-8-3-1-2-4-9(8)10/h2-10,12,22H,11H2,1H3;3-4,9-12,21,23H,5-8H2,1-2H3;6-12H,5H2,1-4H3;4-6,8-10H,7H2,1-3H3;4-7,9H,8H2,1-3H3;3-5,7-9H,6H2,1-2H3,(H,20,21);3-6,8-9H,7,17H2,1-2H3;3-7H,2H2,1H3;2-4,6-7H,5,16H2,1H3;1-4,6-7H,5H2
InChIKeyKSIWHVBETDQSMV-UHFFFAOYSA-N
MW3313.87 g/mol
LogP35.42
Rot. Bonds43

About (5-amino-4-propan-2-yl-1,3-thiazol-2-yl)-(3H-inden-1-yl)methanone;2-(2-hydroxyethoxy)ethyl 3-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-1H-indole-6-carboxylate;3H-inden-1-yl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]methanone;methyl 2-(7-amino-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-anilino-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-(dimethylamino)-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 2-(5-nitro-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylate;propan-2-yl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-5-carboxylate;1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylic acid

(5-amino-4-propan-2-yl-1,3-thiazol-2-yl)-(3H-inden-1-yl)methanone;2-(2-hydroxyethoxy)ethyl 3-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-1H-indole-6-carboxylate;3H-inden-1-yl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]methanone;methyl 2-(7-amino-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-anilino-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-(dimethylamino)-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 2-(5-nitro-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylate;propan-2-yl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-5-carboxylate;1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylic acid (PubChem CID 160563440) has the molecular formula C173H153F3N16O30S10 and a molecular weight of 3313.87 g/mol. Its IUPAC name is (5-amino-4-propan-2-yl-1,3-thiazol-2-yl)-(3H-inden-1-yl)methanone;2-(2-hydroxyethoxy)ethyl 3-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-1H-indole-6-carboxylate;3H-inden-1-yl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]methanone;methyl 2-(7-amino-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-anilino-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-(dimethylamino)-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 2-(5-nitro-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylate;propan-2-yl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-5-carboxylate;1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylic acid.

Molecular Properties

Compound Name(5-amino-4-propan-2-yl-1,3-thiazol-2-yl)-(3H-inden-1-yl)methanone;2-(2-hydroxyethoxy)ethyl 3-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-1H-indole-6-carboxylate;3H-inden-1-yl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]methanone;methyl 2-(7-amino-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-anilino-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-(dimethylamino)-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 2-(5-nitro-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylate;propan-2-yl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-5-carboxylate;1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylic acid
PubChem CID160563440
Molecular FormulaC173H153F3N16O30S10
Molecular Weight3313.87 g/mol
Exact Mass3310.81
IUPAC Name(5-amino-4-propan-2-yl-1,3-thiazol-2-yl)-(3H-inden-1-yl)methanone;2-(2-hydroxyethoxy)ethyl 3-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-1H-indole-6-carboxylate;3H-inden-1-yl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]methanone;methyl 2-(7-amino-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-anilino-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-(dimethylamino)-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 2-(5-nitro-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylate;propan-2-yl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-5-carboxylate;1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylic acid
SMILESCC(C)OC(=O)c1ccc2c(c1)CC=C2C(=O)c1nc(C(C)C)cs1.CC(C)c1csc(C(=O)C2=CCc3c(C(=O)O)cccc32)n1.CC(C)c1csc(C(=O)c2c[nH]c3cc(C(=O)OCCOCCO)ccc23)n1.CC(C)c1nc(C(=O)C2=CCc3ccccc32)sc1N.COC(=O)c1cccc2c1CC=C2C(=O)c1nc(C(C)C)cs1.COC(=O)c1csc(C(=O)C2=CCc3cc([N+](=O)[O-])ccc32)n1.COC(=O)c1csc(C(=O)C2=CCc3cccc(N)c32)n1.COC(=O)c1nc(C(=O)C2=CCc3ccccc32)sc1N(C)C.COC(=O)c1nc(C(=O)C2=CCc3ccccc32)sc1Nc1ccccc1.O=C(C1=CCc2ccccc21)c1nc(C(F)(F)F)cs1
InChIInChI=1S/C21H16N2O3S.C20H22N2O5S.C20H21NO3S.C18H17NO3S.C17H16N2O3S.C17H15NO3S.C16H16N2OS.C15H10N2O5S.C15H12N2O3S.C14H8F3NOS/c1-26-21(25)17-19(22-14-8-3-2-4-9-14)27-20(23-17)18(24)16-12-11-13-7-5-6-10-15(13)16;1-12(2)17-11-28-19(22-17)18(24)15-10-21-16-9-13(3-4-14(15)16)20(25)27-8-7-26-6-5-23;1-11(2)17-10-25-19(21-17)18(22)16-8-5-13-9-14(6-7-15(13)16)20(23)24-12(3)4;1-10(2)15-9-23-17(19-15)16(20)13-8-7-12-11(13)5-4-6-14(12)18(21)22-3;1-19(2)16-13(17(21)22-3)18-15(23-16)14(20)12-9-8-10-6-4-5-7-11(10)12;1-9(2)14-8-22-16(18-14)15(19)12-7-6-11-10(12)4-3-5-13(11)17(20)21;1-9(2)13-15(17)20-16(18-13)14(19)12-8-7-10-5-3-4-6-11(10)12;1-22-15(19)12-7-23-14(16-12)13(18)11-4-2-8-6-9(17(20)21)3-5-10(8)11;1-20-15(19)11-7-21-14(17-11)13(18)9-6-5-8-3-2-4-10(16)12(8)9;15-14(16,17)11-7-20-13(18-11)12(19)10-6-5-8-3-1-2-4-9(8)10/h2-10,12,22H,11H2,1H3;3-4,9-12,21,23H,5-8H2,1-2H3;6-12H,5H2,1-4H3;4-6,8-10H,7H2,1-3H3;4-7,9H,8H2,1-3H3;3-5,7-9H,6H2,1-2H3,(H,20,21);3-6,8-9H,7,17H2,1-2H3;3-7H,2H2,1H3;2-4,6-7H,5,16H2,1H3;1-4,6-7H,5H2
InChIKeyKSIWHVBETDQSMV-UHFFFAOYSA-N
XLogP35.42
TPSA676.70 Ų
H-Bond Donors6
H-Bond Acceptors53
Rotatable Bonds43
Heavy Atoms232
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003313.87
LogP ≤ 535.42
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1053

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze (5-amino-4-propan-2-yl-1,3-thiazol-2-yl)-(3H-inden-1-yl)methanone;2-(2-hydroxyethoxy)ethyl 3-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-1H-indole-6-carboxylate;3H-inden-1-yl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]methanone;methyl 2-(7-amino-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-anilino-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-(dimethylamino)-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 2-(5-nitro-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylate;propan-2-yl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-5-carboxylate;1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (5-amino-4-propan-2-yl-1,3-thiazol-2-yl)-(3H-inden-1-yl)methanone;2-(2-hydroxyethoxy)ethyl 3-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-1H-indole-6-carboxylate;3H-inden-1-yl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]methanone;methyl 2-(7-amino-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-anilino-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-(dimethylamino)-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 2-(5-nitro-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylate;propan-2-yl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-5-carboxylate;1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylic acid?
The IUPAC name of (5-amino-4-propan-2-yl-1,3-thiazol-2-yl)-(3H-inden-1-yl)methanone;2-(2-hydroxyethoxy)ethyl 3-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-1H-indole-6-carboxylate;3H-inden-1-yl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]methanone;methyl 2-(7-amino-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-anilino-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-(dimethylamino)-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 2-(5-nitro-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylate;propan-2-yl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-5-carboxylate;1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylic acid (CID 160563440) is (5-amino-4-propan-2-yl-1,3-thiazol-2-yl)-(3H-inden-1-yl)methanone;2-(2-hydroxyethoxy)ethyl 3-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-1H-indole-6-carboxylate;3H-inden-1-yl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]methanone;methyl 2-(7-amino-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-anilino-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-(dimethylamino)-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 2-(5-nitro-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylate;propan-2-yl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-5-carboxylate;1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylic acid.
What is the SMILES notation for (5-amino-4-propan-2-yl-1,3-thiazol-2-yl)-(3H-inden-1-yl)methanone;2-(2-hydroxyethoxy)ethyl 3-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-1H-indole-6-carboxylate;3H-inden-1-yl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]methanone;methyl 2-(7-amino-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-anilino-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-(dimethylamino)-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 2-(5-nitro-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylate;propan-2-yl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-5-carboxylate;1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylic acid?
The canonical SMILES for (5-amino-4-propan-2-yl-1,3-thiazol-2-yl)-(3H-inden-1-yl)methanone;2-(2-hydroxyethoxy)ethyl 3-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-1H-indole-6-carboxylate;3H-inden-1-yl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]methanone;methyl 2-(7-amino-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-anilino-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-(dimethylamino)-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 2-(5-nitro-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylate;propan-2-yl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-5-carboxylate;1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylic acid is CC(C)OC(=O)c1ccc2c(c1)CC=C2C(=O)c1nc(C(C)C)cs1.CC(C)c1csc(C(=O)C2=CCc3c(C(=O)O)cccc32)n1.CC(C)c1csc(C(=O)c2c[nH]c3cc(C(=O)OCCOCCO)ccc23)n1.CC(C)c1nc(C(=O)C2=CCc3ccccc32)sc1N.COC(=O)c1cccc2c1CC=C2C(=O)c1nc(C(C)C)cs1.COC(=O)c1csc(C(=O)C2=CCc3cc([N+](=O)[O-])ccc32)n1.COC(=O)c1csc(C(=O)C2=CCc3cccc(N)c32)n1.COC(=O)c1nc(C(=O)C2=CCc3ccccc32)sc1N(C)C.COC(=O)c1nc(C(=O)C2=CCc3ccccc32)sc1Nc1ccccc1.O=C(C1=CCc2ccccc21)c1nc(C(F)(F)F)cs1.
What is the InChIKey of (5-amino-4-propan-2-yl-1,3-thiazol-2-yl)-(3H-inden-1-yl)methanone;2-(2-hydroxyethoxy)ethyl 3-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-1H-indole-6-carboxylate;3H-inden-1-yl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]methanone;methyl 2-(7-amino-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-anilino-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-(dimethylamino)-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 2-(5-nitro-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylate;propan-2-yl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-5-carboxylate;1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylic acid?
The InChIKey is KSIWHVBETDQSMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N2O3S.C20H22N2O5S.C20H21NO3S.C18H17NO3S.C17H16N2O3S.C17H15NO3S.C16H16N2OS.C15H10N2O5S.C15H12N2O3S.C14H8F3NOS/c1-26-21(25)17-19(22-14-8-3-2-4-9-14)27-20(23-17)18(24)16-12-11-13-7-5-6-10-15(13)16;1-12(2)17-11-28-19(22-17)18(24)15-10-21-16-9-13(3-4-14(15)16)20(25)27-8-7-26-6-5-23;1-11(2)17-10-25-19(21-17)18(22)16-8-5-13-9-14(6-7-15(13)16)20(23)24-12(3)4;1-10(2)15-9-23-17(19-15)16(20)13-8-7-12-11(13)5-4-6-14(12)18(21)22-3;1-19(2)16-13(17(21)22-3)18-15(23-16)14(20)12-9-8-10-6-4-5-7-11(10)12;1-9(2)14-8-22-16(18-14)15(19)12-7-6-11-10(12)4-3-5-13(11)17(20)21;1-9(2)13-15(17)20-16(18-13)14(19)12-8-7-10-5-3-4-6-11(10)12;1-22-15(19)12-7-23-14(16-12)13(18)11-4-2-8-6-9(17(20)21)3-5-10(8)11;1-20-15(19)11-7-21-14(17-11)13(18)9-6-5-8-3-2-4-10(16)12(8)9;15-14(16,17)11-7-20-13(18-11)12(19)10-6-5-8-3-1-2-4-9(8)10/h2-10,12,22H,11H2,1H3;3-4,9-12,21,23H,5-8H2,1-2H3;6-12H,5H2,1-4H3;4-6,8-10H,7H2,1-3H3;4-7,9H,8H2,1-3H3;3-5,7-9H,6H2,1-2H3,(H,20,21);3-6,8-9H,7,17H2,1-2H3;3-7H,2H2,1H3;2-4,6-7H,5,16H2,1H3;1-4,6-7H,5H2.
What are the key properties of (5-amino-4-propan-2-yl-1,3-thiazol-2-yl)-(3H-inden-1-yl)methanone;2-(2-hydroxyethoxy)ethyl 3-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-1H-indole-6-carboxylate;3H-inden-1-yl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]methanone;methyl 2-(7-amino-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-anilino-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-(dimethylamino)-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 2-(5-nitro-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylate;propan-2-yl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-5-carboxylate;1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylic acid?
(5-amino-4-propan-2-yl-1,3-thiazol-2-yl)-(3H-inden-1-yl)methanone;2-(2-hydroxyethoxy)ethyl 3-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-1H-indole-6-carboxylate;3H-inden-1-yl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]methanone;methyl 2-(7-amino-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-anilino-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-(dimethylamino)-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 2-(5-nitro-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylate;propan-2-yl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-5-carboxylate;1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylic acid has a molecular weight of 3313.87 g/mol, XLogP of 35.42, 43 rotatable bonds, 6 hydrogen bond donors, and 53 hydrogen bond acceptors.
Where does this data come from?
All data for (5-amino-4-propan-2-yl-1,3-thiazol-2-yl)-(3H-inden-1-yl)methanone;2-(2-hydroxyethoxy)ethyl 3-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-1H-indole-6-carboxylate;3H-inden-1-yl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]methanone;methyl 2-(7-amino-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-anilino-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 5-(dimethylamino)-2-(3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 2-(5-nitro-3H-indene-1-carbonyl)-1,3-thiazole-4-carboxylate;methyl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylate;propan-2-yl 1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-5-carboxylate;1-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-3H-indene-4-carboxylic acid is sourced from PubChem (CID 160563440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).