1-[(3-cyclopropyl-1,2,4-triazol-1-yl)sulfonyl]-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)urea;1-(dimethylsulfamoyl)-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)urea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-methylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-morpholin-4-ylsulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(3-propan-2-ylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-propan-2-ylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-propan-2-yltriazol-1-yl)sulfonylurea

C123H156N28O22S7 — CID 157056001

About 1-[(3-cyclopropyl-1,2,4-triazol-1-yl)sulfonyl]-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)urea;1-(dimethylsulfamoyl)-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)urea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-methylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-morpholin-4-ylsulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(3-propan-2-ylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-propan-2-ylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-propan-2-yltriazol-1-yl)sulfonylurea

1-[(3-cyclopropyl-1,2,4-triazol-1-yl)sulfonyl]-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)urea;1-(dimethylsulfamoyl)-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)urea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-methylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-morpholin-4-ylsulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(3-propan-2-ylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-propan-2-ylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-propan-2-yltriazol-1-yl)sulfonylurea (PubChem CID 157056001) has the molecular formula C123H156N28O22S7 and a molecular weight of 2603.24 g/mol. Its IUPAC name is 1-[(3-cyclopropyl-1,2,4-triazol-1-yl)sulfonyl]-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)urea;1-(dimethylsulfamoyl)-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)urea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-methylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-morpholin-4-ylsulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(3-propan-2-ylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-propan-2-ylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-propan-2-yltriazol-1-yl)sulfonylurea.

Molecular Properties

• Compound Name: 1-[(3-cyclopropyl-1,2,4-triazol-1-yl)sulfonyl]-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)urea;1-(dimethylsulfamoyl)-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)urea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-methylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-morpholin-4-ylsulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(3-propan-2-ylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-propan-2-ylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-propan-2-yltriazol-1-yl)sulfonylurea
• PubChem CID: 157056001
• Molecular Formula: C123H156N28O22S7
• Molecular Weight: 2603.24 g/mol
• Exact Mass: 2601.00
• IUPAC Name: 1-[(3-cyclopropyl-1,2,4-triazol-1-yl)sulfonyl]-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)urea;1-(dimethylsulfamoyl)-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)urea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-methylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-morpholin-4-ylsulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(3-propan-2-ylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-propan-2-ylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-propan-2-yltriazol-1-yl)sulfonylurea
• SMILES: CC(C)c1ccn(S(=O)(=O)NC(=O)Nc2c3c(cc4c2CCC4)CCC3)n1.CC(C)c1cn(S(=O)(=O)NC(=O)Nc2c3c(cc4c2CCC4)CCC3)nn1.CC(C)c1cnn(S(=O)(=O)NC(=O)Nc2c3c(cc4c2CCC4)CCC3)c1.CN(C)S(=O)(=O)NC(=O)Nc1c2c(cc3c1CCC3)CCC2.Cc1cnn(S(=O)(=O)NC(=O)Nc2c3c(cc4c2CCC4)CCC3)c1.O=C(Nc1c2c(cc3c1CCC3)CCC2)NS(=O)(=O)N1CCOCC1.O=C(Nc1c2c(cc3c1CCC3)CCC2)NS(=O)(=O)n1cnc(C2CC2)n1
• InChI: InChI=1S/2C19H24N4O3S.C18H21N5O3S.C18H23N5O3S.C17H20N4O3S.C17H23N3O4S.C15H21N3O3S/c1-12(2)15-10-20-23(11-15)27(25,26)22-19(24)21-18-16-7-3-5-13(16)9-14-6-4-8-17(14)18;1-12(2)17-9-10-23(21-17)27(25,26)22-19(24)20-18-15-7-3-5-13(15)11-14-6-4-8-16(14)18;24-18(22-27(25,26)23-10-19-17(21-23)11-7-8-11)20-16-14-5-1-3-12(14)9-13-4-2-6-15(13)16;1-11(2)16-10-23(22-20-16)27(25,26)21-18(24)19-17-14-7-3-5-12(14)9-13-6-4-8-15(13)17;1-11-9-18-21(10-11)25(23,24)20-17(22)19-16-14-6-2-4-12(14)8-13-5-3-7-15(13)16;21-17(19-25(22,23)20-7-9-24-10-8-20)18-16-14-5-1-3-12(14)11-13-4-2-6-15(13)16;1-18(2)22(20,21)17-15(19)16-14-12-7-3-5-10(12)9-11-6-4-8-13(11)14/h9-12H,3-8H2,1-2H3,(H2,21,22,24);9-12H,3-8H2,1-2H3,(H2,20,22,24);9-11H,1-8H2,(H2,20,22,24);9-11H,3-8H2,1-2H3,(H2,19,21,24);8-10H,2-7H2,1H3,(H2,19,20,22);11H,1-10H2,(H2,18,19,21);9H,3-8H2,1-2H3,(H2,16,17,19)
• InChIKey: AATLMJHRGSBSGV-UHFFFAOYSA-N
• XLogP: 15.18
• TPSA: 657.48 Ų
• H-Bond Donors: 14
• H-Bond Acceptors: 34
• Rotatable Bonds: 25
• Heavy Atoms: 180
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2603.24
LogP ≤ 5	15.18
H-Bond Donors ≤ 5	14
H-Bond Acceptors ≤ 10	34

Frequently Asked Questions

What is the IUPAC name of 1-[(3-cyclopropyl-1,2,4-triazol-1-yl)sulfonyl]-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)urea;1-(dimethylsulfamoyl)-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)urea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-methylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-morpholin-4-ylsulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(3-propan-2-ylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-propan-2-ylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-propan-2-yltriazol-1-yl)sulfonylurea?

The IUPAC name of 1-[(3-cyclopropyl-1,2,4-triazol-1-yl)sulfonyl]-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)urea;1-(dimethylsulfamoyl)-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)urea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-methylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-morpholin-4-ylsulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(3-propan-2-ylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-propan-2-ylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-propan-2-yltriazol-1-yl)sulfonylurea (CID 157056001) is 1-[(3-cyclopropyl-1,2,4-triazol-1-yl)sulfonyl]-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)urea;1-(dimethylsulfamoyl)-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)urea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-methylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-morpholin-4-ylsulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(3-propan-2-ylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-propan-2-ylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-propan-2-yltriazol-1-yl)sulfonylurea.

What is the SMILES notation for 1-[(3-cyclopropyl-1,2,4-triazol-1-yl)sulfonyl]-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)urea;1-(dimethylsulfamoyl)-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)urea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-methylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-morpholin-4-ylsulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(3-propan-2-ylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-propan-2-ylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-propan-2-yltriazol-1-yl)sulfonylurea?

The canonical SMILES for 1-[(3-cyclopropyl-1,2,4-triazol-1-yl)sulfonyl]-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)urea;1-(dimethylsulfamoyl)-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)urea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-methylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-morpholin-4-ylsulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(3-propan-2-ylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-propan-2-ylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-propan-2-yltriazol-1-yl)sulfonylurea is CC(C)c1ccn(S(=O)(=O)NC(=O)Nc2c3c(cc4c2CCC4)CCC3)n1.CC(C)c1cn(S(=O)(=O)NC(=O)Nc2c3c(cc4c2CCC4)CCC3)nn1.CC(C)c1cnn(S(=O)(=O)NC(=O)Nc2c3c(cc4c2CCC4)CCC3)c1.CN(C)S(=O)(=O)NC(=O)Nc1c2c(cc3c1CCC3)CCC2.Cc1cnn(S(=O)(=O)NC(=O)Nc2c3c(cc4c2CCC4)CCC3)c1.O=C(Nc1c2c(cc3c1CCC3)CCC2)NS(=O)(=O)N1CCOCC1.O=C(Nc1c2c(cc3c1CCC3)CCC2)NS(=O)(=O)n1cnc(C2CC2)n1.

What is the InChIKey of 1-[(3-cyclopropyl-1,2,4-triazol-1-yl)sulfonyl]-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)urea;1-(dimethylsulfamoyl)-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)urea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-methylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-morpholin-4-ylsulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(3-propan-2-ylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-propan-2-ylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-propan-2-yltriazol-1-yl)sulfonylurea?

The InChIKey is AATLMJHRGSBSGV-UHFFFAOYSA-N. The full InChI is InChI=1S/2C19H24N4O3S.C18H21N5O3S.C18H23N5O3S.C17H20N4O3S.C17H23N3O4S.C15H21N3O3S/c1-12(2)15-10-20-23(11-15)27(25,26)22-19(24)21-18-16-7-3-5-13(16)9-14-6-4-8-17(14)18;1-12(2)17-9-10-23(21-17)27(25,26)22-19(24)20-18-15-7-3-5-13(15)11-14-6-4-8-16(14)18;24-18(22-27(25,26)23-10-19-17(21-23)11-7-8-11)20-16-14-5-1-3-12(14)9-13-4-2-6-15(13)16;1-11(2)16-10-23(22-20-16)27(25,26)21-18(24)19-17-14-7-3-5-12(14)9-13-6-4-8-15(13)17;1-11-9-18-21(10-11)25(23,24)20-17(22)19-16-14-6-2-4-12(14)8-13-5-3-7-15(13)16;21-17(19-25(22,23)20-7-9-24-10-8-20)18-16-14-5-1-3-12(14)11-13-4-2-6-15(13)16;1-18(2)22(20,21)17-15(19)16-14-12-7-3-5-10(12)9-11-6-4-8-13(11)14/h9-12H,3-8H2,1-2H3,(H2,21,22,24);9-12H,3-8H2,1-2H3,(H2,20,22,24);9-11H,1-8H2,(H2,20,22,24);9-11H,3-8H2,1-2H3,(H2,19,21,24);8-10H,2-7H2,1H3,(H2,19,20,22);11H,1-10H2,(H2,18,19,21);9H,3-8H2,1-2H3,(H2,16,17,19).

What are the key properties of 1-[(3-cyclopropyl-1,2,4-triazol-1-yl)sulfonyl]-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)urea;1-(dimethylsulfamoyl)-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)urea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-methylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-morpholin-4-ylsulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(3-propan-2-ylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-propan-2-ylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-propan-2-yltriazol-1-yl)sulfonylurea?

1-[(3-cyclopropyl-1,2,4-triazol-1-yl)sulfonyl]-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)urea;1-(dimethylsulfamoyl)-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)urea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-methylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-morpholin-4-ylsulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(3-propan-2-ylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-propan-2-ylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-propan-2-yltriazol-1-yl)sulfonylurea has a molecular weight of 2603.24 g/mol, XLogP of 15.18, 25 rotatable bonds, 14 hydrogen bond donors, and 34 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[(3-cyclopropyl-1,2,4-triazol-1-yl)sulfonyl]-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)urea;1-(dimethylsulfamoyl)-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)urea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-methylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-morpholin-4-ylsulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(3-propan-2-ylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-propan-2-ylpyrazol-1-yl)sulfonylurea;1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(4-propan-2-yltriazol-1-yl)sulfonylurea is sourced from PubChem (CID 157056001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).