carbanide;18-cyclohexyl-N-(dimethylsulfamoyl)-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,12(17),13,15-heptaene-14-carboxamide;18-cyclohexyl-N-(dimethylsulfamoyl)-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,8,12(17),13,15-octaene-14-carboxamide;18-cyclohexyl-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,8,12(17),13,15-octaene-14-carboxylic acid;[methyl(sulfamoyl)amino]methane;palladium

C91H112N15O16PdS3- — CID 158314148

About carbanide;18-cyclohexyl-N-(dimethylsulfamoyl)-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,12(17),13,15-heptaene-14-carboxamide;18-cyclohexyl-N-(dimethylsulfamoyl)-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,8,12(17),13,15-octaene-14-carboxamide;18-cyclohexyl-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,8,12(17),13,15-octaene-14-carboxylic acid;[methyl(sulfamoyl)amino]methane;palladium

carbanide;18-cyclohexyl-N-(dimethylsulfamoyl)-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,12(17),13,15-heptaene-14-carboxamide;18-cyclohexyl-N-(dimethylsulfamoyl)-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,8,12(17),13,15-octaene-14-carboxamide;18-cyclohexyl-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,8,12(17),13,15-octaene-14-carboxylic acid;[methyl(sulfamoyl)amino]methane;palladium (PubChem CID 158314148) has the molecular formula C91H112N15O16PdS3- and a molecular weight of 1874.61 g/mol. Its IUPAC name is carbanide;18-cyclohexyl-N-(dimethylsulfamoyl)-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,12(17),13,15-heptaene-14-carboxamide;18-cyclohexyl-N-(dimethylsulfamoyl)-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,8,12(17),13,15-octaene-14-carboxamide;18-cyclohexyl-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,8,12(17),13,15-octaene-14-carboxylic acid;[methyl(sulfamoyl)amino]methane;palladium.

Molecular Properties

• Compound Name: carbanide;18-cyclohexyl-N-(dimethylsulfamoyl)-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,12(17),13,15-heptaene-14-carboxamide;18-cyclohexyl-N-(dimethylsulfamoyl)-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,8,12(17),13,15-octaene-14-carboxamide;18-cyclohexyl-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,8,12(17),13,15-octaene-14-carboxylic acid;[methyl(sulfamoyl)amino]methane;palladium
• PubChem CID: 158314148
• Molecular Formula: C91H112N15O16PdS3-
• Molecular Weight: 1874.61 g/mol
• Exact Mass: 1872.66
• IUPAC Name: carbanide;18-cyclohexyl-N-(dimethylsulfamoyl)-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,12(17),13,15-heptaene-14-carboxamide;18-cyclohexyl-N-(dimethylsulfamoyl)-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,8,12(17),13,15-octaene-14-carboxamide;18-cyclohexyl-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,8,12(17),13,15-octaene-14-carboxylic acid;[methyl(sulfamoyl)amino]methane;palladium
• SMILES: CN(C)S(=O)(=O)NC(=O)c1ccc2c(C3CCCCC3)c3n(c2c1)CC(C(=O)N1CCOCC1)=Cc1cccnc1-3.CN(C)S(=O)(=O)NC(=O)c1ccc2c(C3CCCCC3)c3n(c2c1)CC(C(=O)N1CCOCC1)Cc1cccnc1-3.CN(C)S(N)(=O)=O.O=C(O)c1ccc2c(C3CCCCC3)c3n(c2c1)CC(C(=O)N1CCOCC1)=Cc1cccnc1-3.[CH3-].[Pd]
• InChI: InChI=1S/C30H37N5O5S.C30H35N5O5S.C28H29N3O4.C2H8N2O2S.CH3.Pd/c2*1-33(2)41(38,39)32-29(36)22-10-11-24-25(18-22)35-19-23(30(37)34-13-15-40-16-14-34)17-21-9-6-12-31-27(21)28(35)26(24)20-7-4-3-5-8-20;32-27(30-11-13-35-14-12-30)21-15-19-7-4-10-29-25(19)26-24(18-5-2-1-3-6-18)22-9-8-20(28(33)34)16-23(22)31(26)17-21;1-4(2)7(3,5)6;;/h6,9-12,18,20,23H,3-5,7-8,13-17,19H2,1-2H3,(H,32,36);6,9-12,17-18,20H,3-5,7-8,13-16,19H2,1-2H3,(H,32,36);4,7-10,15-16,18H,1-3,5-6,11-14,17H2,(H,33,34);1-2H3,(H2,3,5,6);1H3;/q;;;;-1
• InChIKey: CRKLFBXYYOPANM-UHFFFAOYSA-N
• XLogP: 10.77
• TPSA: 375.74 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 21
• Rotatable Bonds: 14
• Heavy Atoms: 126
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1874.61
LogP ≤ 5	10.77
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of carbanide;18-cyclohexyl-N-(dimethylsulfamoyl)-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,12(17),13,15-heptaene-14-carboxamide;18-cyclohexyl-N-(dimethylsulfamoyl)-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,8,12(17),13,15-octaene-14-carboxamide;18-cyclohexyl-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,8,12(17),13,15-octaene-14-carboxylic acid;[methyl(sulfamoyl)amino]methane;palladium?

The IUPAC name of carbanide;18-cyclohexyl-N-(dimethylsulfamoyl)-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,12(17),13,15-heptaene-14-carboxamide;18-cyclohexyl-N-(dimethylsulfamoyl)-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,8,12(17),13,15-octaene-14-carboxamide;18-cyclohexyl-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,8,12(17),13,15-octaene-14-carboxylic acid;[methyl(sulfamoyl)amino]methane;palladium (CID 158314148) is carbanide;18-cyclohexyl-N-(dimethylsulfamoyl)-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,12(17),13,15-heptaene-14-carboxamide;18-cyclohexyl-N-(dimethylsulfamoyl)-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,8,12(17),13,15-octaene-14-carboxamide;18-cyclohexyl-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,8,12(17),13,15-octaene-14-carboxylic acid;[methyl(sulfamoyl)amino]methane;palladium.

What is the SMILES notation for carbanide;18-cyclohexyl-N-(dimethylsulfamoyl)-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,12(17),13,15-heptaene-14-carboxamide;18-cyclohexyl-N-(dimethylsulfamoyl)-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,8,12(17),13,15-octaene-14-carboxamide;18-cyclohexyl-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,8,12(17),13,15-octaene-14-carboxylic acid;[methyl(sulfamoyl)amino]methane;palladium?

The canonical SMILES for carbanide;18-cyclohexyl-N-(dimethylsulfamoyl)-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,12(17),13,15-heptaene-14-carboxamide;18-cyclohexyl-N-(dimethylsulfamoyl)-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,8,12(17),13,15-octaene-14-carboxamide;18-cyclohexyl-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,8,12(17),13,15-octaene-14-carboxylic acid;[methyl(sulfamoyl)amino]methane;palladium is CN(C)S(=O)(=O)NC(=O)c1ccc2c(C3CCCCC3)c3n(c2c1)CC(C(=O)N1CCOCC1)=Cc1cccnc1-3.CN(C)S(=O)(=O)NC(=O)c1ccc2c(C3CCCCC3)c3n(c2c1)CC(C(=O)N1CCOCC1)Cc1cccnc1-3.CN(C)S(N)(=O)=O.O=C(O)c1ccc2c(C3CCCCC3)c3n(c2c1)CC(C(=O)N1CCOCC1)=Cc1cccnc1-3.[CH3-].[Pd].

What is the InChIKey of carbanide;18-cyclohexyl-N-(dimethylsulfamoyl)-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,12(17),13,15-heptaene-14-carboxamide;18-cyclohexyl-N-(dimethylsulfamoyl)-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,8,12(17),13,15-octaene-14-carboxamide;18-cyclohexyl-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,8,12(17),13,15-octaene-14-carboxylic acid;[methyl(sulfamoyl)amino]methane;palladium?

The InChIKey is CRKLFBXYYOPANM-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H37N5O5S.C30H35N5O5S.C28H29N3O4.C2H8N2O2S.CH3.Pd/c2*1-33(2)41(38,39)32-29(36)22-10-11-24-25(18-22)35-19-23(30(37)34-13-15-40-16-14-34)17-21-9-6-12-31-27(21)28(35)26(24)20-7-4-3-5-8-20;32-27(30-11-13-35-14-12-30)21-15-19-7-4-10-29-25(19)26-24(18-5-2-1-3-6-18)22-9-8-20(28(33)34)16-23(22)31(26)17-21;1-4(2)7(3,5)6;;/h6,9-12,18,20,23H,3-5,7-8,13-17,19H2,1-2H3,(H,32,36);6,9-12,17-18,20H,3-5,7-8,13-16,19H2,1-2H3,(H,32,36);4,7-10,15-16,18H,1-3,5-6,11-14,17H2,(H,33,34);1-2H3,(H2,3,5,6);1H3;/q;;;;-1;.

What are the key properties of carbanide;18-cyclohexyl-N-(dimethylsulfamoyl)-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,12(17),13,15-heptaene-14-carboxamide;18-cyclohexyl-N-(dimethylsulfamoyl)-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,8,12(17),13,15-octaene-14-carboxamide;18-cyclohexyl-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,8,12(17),13,15-octaene-14-carboxylic acid;[methyl(sulfamoyl)amino]methane;palladium?

carbanide;18-cyclohexyl-N-(dimethylsulfamoyl)-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,12(17),13,15-heptaene-14-carboxamide;18-cyclohexyl-N-(dimethylsulfamoyl)-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,8,12(17),13,15-octaene-14-carboxamide;18-cyclohexyl-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,8,12(17),13,15-octaene-14-carboxylic acid;[methyl(sulfamoyl)amino]methane;palladium has a molecular weight of 1874.61 g/mol, XLogP of 10.77, 14 rotatable bonds, 4 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for carbanide;18-cyclohexyl-N-(dimethylsulfamoyl)-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,12(17),13,15-heptaene-14-carboxamide;18-cyclohexyl-N-(dimethylsulfamoyl)-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,8,12(17),13,15-octaene-14-carboxamide;18-cyclohexyl-9-(morpholine-4-carbonyl)-3,11-diazatetracyclo[9.7.0.02,7.012,17]octadeca-1(18),2(7),3,5,8,12(17),13,15-octaene-14-carboxylic acid;[methyl(sulfamoyl)amino]methane;palladium is sourced from PubChem (CID 158314148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).