4-(cyclohexylmethyl)-N,N-dimethyl-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide;4-(cyclohexylmethyl)-N-methyl-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide;bis(4-(cyclohexylmethyl)-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide);2-(4-methylphenyl)-4-(piperidin-4-ylmethyl)thieno[2,3-d]pyridazine-7-carboxamide

C107H120N16O5S5 — CID 157309486

About 4-(cyclohexylmethyl)-N,N-dimethyl-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide;4-(cyclohexylmethyl)-N-methyl-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide;bis(4-(cyclohexylmethyl)-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide);2-(4-methylphenyl)-4-(piperidin-4-ylmethyl)thieno[2,3-d]pyridazine-7-carboxamide

4-(cyclohexylmethyl)-N,N-dimethyl-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide;4-(cyclohexylmethyl)-N-methyl-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide;bis(4-(cyclohexylmethyl)-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide);2-(4-methylphenyl)-4-(piperidin-4-ylmethyl)thieno[2,3-d]pyridazine-7-carboxamide (PubChem CID 157309486) has the molecular formula C107H120N16O5S5 and a molecular weight of 1870.58 g/mol. Its IUPAC name is 4-(cyclohexylmethyl)-N,N-dimethyl-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide;4-(cyclohexylmethyl)-N-methyl-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide;bis(4-(cyclohexylmethyl)-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide);2-(4-methylphenyl)-4-(piperidin-4-ylmethyl)thieno[2,3-d]pyridazine-7-carboxamide.

Molecular Properties

• Compound Name: 4-(cyclohexylmethyl)-N,N-dimethyl-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide;4-(cyclohexylmethyl)-N-methyl-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide;bis(4-(cyclohexylmethyl)-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide);2-(4-methylphenyl)-4-(piperidin-4-ylmethyl)thieno[2,3-d]pyridazine-7-carboxamide
• PubChem CID: 157309486
• Molecular Formula: C107H120N16O5S5
• Molecular Weight: 1870.58 g/mol
• Exact Mass: 1868.82
• IUPAC Name: 4-(cyclohexylmethyl)-N,N-dimethyl-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide;4-(cyclohexylmethyl)-N-methyl-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide;bis(4-(cyclohexylmethyl)-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide);2-(4-methylphenyl)-4-(piperidin-4-ylmethyl)thieno[2,3-d]pyridazine-7-carboxamide
• SMILES: CNC(=O)c1nnc(CC2CCCCC2)c2cc(-c3ccc(C)cc3)sc12.Cc1ccc(-c2cc3c(CC4CCCCC4)nnc(C(=O)N(C)C)c3s2)cc1.Cc1ccc(-c2cc3c(CC4CCCCC4)nnc(C(N)=O)c3s2)cc1.Cc1ccc(-c2cc3c(CC4CCCCC4)nnc(C(N)=O)c3s2)cc1.Cc1ccc(-c2cc3c(CC4CCNCC4)nnc(C(N)=O)c3s2)cc1
• InChI: InChI=1S/C23H27N3OS.C22H25N3OS.2C21H23N3OS.C20H22N4OS/c1-15-9-11-17(12-10-15)20-14-18-19(13-16-7-5-4-6-8-16)24-25-21(22(18)28-20)23(27)26(2)3;1-14-8-10-16(11-9-14)19-13-17-18(12-15-6-4-3-5-7-15)24-25-20(21(17)27-19)22(26)23-2;2*1-13-7-9-15(10-8-13)18-12-16-17(11-14-5-3-2-4-6-14)23-24-19(21(22)25)20(16)26-18;1-12-2-4-14(5-3-12)17-11-15-16(10-13-6-8-22-9-7-13)23-24-18(20(21)25)19(15)26-17/h9-12,14,16H,4-8,13H2,1-3H3;8-11,13,15H,3-7,12H2,1-2H3,(H,23,26);2*7-10,12,14H,2-6,11H2,1H3,(H2,22,25);2-5,11,13,22H,6-10H2,1H3,(H2,21,25)
• InChIKey: BCWHVBLBLHLDLZ-UHFFFAOYSA-N
• XLogP: 23.73
• TPSA: 319.61 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 21
• Rotatable Bonds: 20
• Heavy Atoms: 133
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1870.58
LogP ≤ 5	23.73
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	21

Frequently Asked Questions

What is the IUPAC name of 4-(cyclohexylmethyl)-N,N-dimethyl-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide;4-(cyclohexylmethyl)-N-methyl-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide;bis(4-(cyclohexylmethyl)-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide);2-(4-methylphenyl)-4-(piperidin-4-ylmethyl)thieno[2,3-d]pyridazine-7-carboxamide?

The IUPAC name of 4-(cyclohexylmethyl)-N,N-dimethyl-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide;4-(cyclohexylmethyl)-N-methyl-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide;bis(4-(cyclohexylmethyl)-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide);2-(4-methylphenyl)-4-(piperidin-4-ylmethyl)thieno[2,3-d]pyridazine-7-carboxamide (CID 157309486) is 4-(cyclohexylmethyl)-N,N-dimethyl-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide;4-(cyclohexylmethyl)-N-methyl-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide;bis(4-(cyclohexylmethyl)-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide);2-(4-methylphenyl)-4-(piperidin-4-ylmethyl)thieno[2,3-d]pyridazine-7-carboxamide.

What is the SMILES notation for 4-(cyclohexylmethyl)-N,N-dimethyl-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide;4-(cyclohexylmethyl)-N-methyl-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide;bis(4-(cyclohexylmethyl)-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide);2-(4-methylphenyl)-4-(piperidin-4-ylmethyl)thieno[2,3-d]pyridazine-7-carboxamide?

The canonical SMILES for 4-(cyclohexylmethyl)-N,N-dimethyl-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide;4-(cyclohexylmethyl)-N-methyl-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide;bis(4-(cyclohexylmethyl)-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide);2-(4-methylphenyl)-4-(piperidin-4-ylmethyl)thieno[2,3-d]pyridazine-7-carboxamide is CNC(=O)c1nnc(CC2CCCCC2)c2cc(-c3ccc(C)cc3)sc12.Cc1ccc(-c2cc3c(CC4CCCCC4)nnc(C(=O)N(C)C)c3s2)cc1.Cc1ccc(-c2cc3c(CC4CCCCC4)nnc(C(N)=O)c3s2)cc1.Cc1ccc(-c2cc3c(CC4CCCCC4)nnc(C(N)=O)c3s2)cc1.Cc1ccc(-c2cc3c(CC4CCNCC4)nnc(C(N)=O)c3s2)cc1.

What is the InChIKey of 4-(cyclohexylmethyl)-N,N-dimethyl-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide;4-(cyclohexylmethyl)-N-methyl-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide;bis(4-(cyclohexylmethyl)-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide);2-(4-methylphenyl)-4-(piperidin-4-ylmethyl)thieno[2,3-d]pyridazine-7-carboxamide?

The InChIKey is BCWHVBLBLHLDLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27N3OS.C22H25N3OS.2C21H23N3OS.C20H22N4OS/c1-15-9-11-17(12-10-15)20-14-18-19(13-16-7-5-4-6-8-16)24-25-21(22(18)28-20)23(27)26(2)3;1-14-8-10-16(11-9-14)19-13-17-18(12-15-6-4-3-5-7-15)24-25-20(21(17)27-19)22(26)23-2;2*1-13-7-9-15(10-8-13)18-12-16-17(11-14-5-3-2-4-6-14)23-24-19(21(22)25)20(16)26-18;1-12-2-4-14(5-3-12)17-11-15-16(10-13-6-8-22-9-7-13)23-24-18(20(21)25)19(15)26-17/h9-12,14,16H,4-8,13H2,1-3H3;8-11,13,15H,3-7,12H2,1-2H3,(H,23,26);2*7-10,12,14H,2-6,11H2,1H3,(H2,22,25);2-5,11,13,22H,6-10H2,1H3,(H2,21,25).

What are the key properties of 4-(cyclohexylmethyl)-N,N-dimethyl-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide;4-(cyclohexylmethyl)-N-methyl-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide;bis(4-(cyclohexylmethyl)-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide);2-(4-methylphenyl)-4-(piperidin-4-ylmethyl)thieno[2,3-d]pyridazine-7-carboxamide?

4-(cyclohexylmethyl)-N,N-dimethyl-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide;4-(cyclohexylmethyl)-N-methyl-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide;bis(4-(cyclohexylmethyl)-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide);2-(4-methylphenyl)-4-(piperidin-4-ylmethyl)thieno[2,3-d]pyridazine-7-carboxamide has a molecular weight of 1870.58 g/mol, XLogP of 23.73, 20 rotatable bonds, 5 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(cyclohexylmethyl)-N,N-dimethyl-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide;4-(cyclohexylmethyl)-N-methyl-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide;bis(4-(cyclohexylmethyl)-2-(4-methylphenyl)thieno[2,3-d]pyridazine-7-carboxamide);2-(4-methylphenyl)-4-(piperidin-4-ylmethyl)thieno[2,3-d]pyridazine-7-carboxamide is sourced from PubChem (CID 157309486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).