10a-(4-chlorophenyl)-1-(cyclopenta-1,4-diene-1-carbonyl)-3,10-dihydro-2H-imidazo[2,1-g][1,7]naphthyridin-5-one;10a-(4-chlorophenyl)-1-(2-methyl-1,3-thiazole-4-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one;bis(10a-(4-chlorophenyl)-1-(3-methylthiophene-2-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one);1-(3-chlorobenzoyl)-10a-(4-chlorophenyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one

C110H88Cl6N16O10S3 — CID 160974856

About 10a-(4-chlorophenyl)-1-(cyclopenta-1,4-diene-1-carbonyl)-3,10-dihydro-2H-imidazo[2,1-g][1,7]naphthyridin-5-one;10a-(4-chlorophenyl)-1-(2-methyl-1,3-thiazole-4-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one;bis(10a-(4-chlorophenyl)-1-(3-methylthiophene-2-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one);1-(3-chlorobenzoyl)-10a-(4-chlorophenyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one

10a-(4-chlorophenyl)-1-(cyclopenta-1,4-diene-1-carbonyl)-3,10-dihydro-2H-imidazo[2,1-g][1,7]naphthyridin-5-one;10a-(4-chlorophenyl)-1-(2-methyl-1,3-thiazole-4-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one;bis(10a-(4-chlorophenyl)-1-(3-methylthiophene-2-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one);1-(3-chlorobenzoyl)-10a-(4-chlorophenyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one (PubChem CID 160974856) has the molecular formula C110H88Cl6N16O10S3 and a molecular weight of 2102.93 g/mol. Its IUPAC name is 10a-(4-chlorophenyl)-1-(cyclopenta-1,4-diene-1-carbonyl)-3,10-dihydro-2H-imidazo[2,1-g][1,7]naphthyridin-5-one;10a-(4-chlorophenyl)-1-(2-methyl-1,3-thiazole-4-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one;bis(10a-(4-chlorophenyl)-1-(3-methylthiophene-2-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one);1-(3-chlorobenzoyl)-10a-(4-chlorophenyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one.

Molecular Properties

• Compound Name: 10a-(4-chlorophenyl)-1-(cyclopenta-1,4-diene-1-carbonyl)-3,10-dihydro-2H-imidazo[2,1-g][1,7]naphthyridin-5-one;10a-(4-chlorophenyl)-1-(2-methyl-1,3-thiazole-4-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one;bis(10a-(4-chlorophenyl)-1-(3-methylthiophene-2-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one);1-(3-chlorobenzoyl)-10a-(4-chlorophenyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one
• PubChem CID: 160974856
• Molecular Formula: C110H88Cl6N16O10S3
• Molecular Weight: 2102.93 g/mol
• Exact Mass: 2098.42
• IUPAC Name: 10a-(4-chlorophenyl)-1-(cyclopenta-1,4-diene-1-carbonyl)-3,10-dihydro-2H-imidazo[2,1-g][1,7]naphthyridin-5-one;10a-(4-chlorophenyl)-1-(2-methyl-1,3-thiazole-4-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one;bis(10a-(4-chlorophenyl)-1-(3-methylthiophene-2-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one);1-(3-chlorobenzoyl)-10a-(4-chlorophenyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one
• SMILES: Cc1ccsc1C(=O)N1CCN2C(=O)c3cccnc3CC21c1ccc(Cl)cc1.Cc1ccsc1C(=O)N1CCN2C(=O)c3cccnc3CC21c1ccc(Cl)cc1.Cc1nc(C(=O)N2CCN3C(=O)c4cccnc4CC23c2ccc(Cl)cc2)cs1.O=C(C1=CCC=C1)N1CCN2C(=O)c3ncccc3CC12c1ccc(Cl)cc1.O=C(c1cccc(Cl)c1)N1CCN2C(=O)c3cccnc3CC12c1ccc(Cl)cc1
• InChI: InChI=1S/C23H17Cl2N3O2.2C22H18ClN3O2S.C22H18ClN3O2.C21H17ClN4O2S/c24-17-8-6-16(7-9-17)23-14-20-19(5-2-10-26-20)22(30)28(23)12-11-27(23)21(29)15-3-1-4-18(25)13-15;2*1-14-8-12-29-19(14)21(28)26-11-10-25-20(27)17-3-2-9-24-18(17)13-22(25,26)15-4-6-16(23)7-5-15;23-18-9-7-17(8-10-18)22-14-16-6-3-11-24-19(16)21(28)26(22)13-12-25(22)20(27)15-4-1-2-5-15;1-13-24-18(12-29-13)20(28)26-10-9-25-19(27)16-3-2-8-23-17(16)11-21(25,26)14-4-6-15(22)7-5-14/h1-10,13H,11-12,14H2;2*2-9,12H,10-11,13H2,1H3;1,3-11H,2,12-14H2;2-8,12H,9-11H2,1H3
• InChIKey: SYSLWBZKYBVDDB-UHFFFAOYSA-N
• XLogP: 19.44
• TPSA: 280.44 Ų
• H-Bond Acceptors: 19
• Rotatable Bonds: 10
• Heavy Atoms: 145
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2102.93
LogP ≤ 5	19.44
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	19

Frequently Asked Questions

What is the IUPAC name of 10a-(4-chlorophenyl)-1-(cyclopenta-1,4-diene-1-carbonyl)-3,10-dihydro-2H-imidazo[2,1-g][1,7]naphthyridin-5-one;10a-(4-chlorophenyl)-1-(2-methyl-1,3-thiazole-4-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one;bis(10a-(4-chlorophenyl)-1-(3-methylthiophene-2-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one);1-(3-chlorobenzoyl)-10a-(4-chlorophenyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one?

The IUPAC name of 10a-(4-chlorophenyl)-1-(cyclopenta-1,4-diene-1-carbonyl)-3,10-dihydro-2H-imidazo[2,1-g][1,7]naphthyridin-5-one;10a-(4-chlorophenyl)-1-(2-methyl-1,3-thiazole-4-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one;bis(10a-(4-chlorophenyl)-1-(3-methylthiophene-2-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one);1-(3-chlorobenzoyl)-10a-(4-chlorophenyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one (CID 160974856) is 10a-(4-chlorophenyl)-1-(cyclopenta-1,4-diene-1-carbonyl)-3,10-dihydro-2H-imidazo[2,1-g][1,7]naphthyridin-5-one;10a-(4-chlorophenyl)-1-(2-methyl-1,3-thiazole-4-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one;bis(10a-(4-chlorophenyl)-1-(3-methylthiophene-2-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one);1-(3-chlorobenzoyl)-10a-(4-chlorophenyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one.

What is the SMILES notation for 10a-(4-chlorophenyl)-1-(cyclopenta-1,4-diene-1-carbonyl)-3,10-dihydro-2H-imidazo[2,1-g][1,7]naphthyridin-5-one;10a-(4-chlorophenyl)-1-(2-methyl-1,3-thiazole-4-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one;bis(10a-(4-chlorophenyl)-1-(3-methylthiophene-2-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one);1-(3-chlorobenzoyl)-10a-(4-chlorophenyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one?

The canonical SMILES for 10a-(4-chlorophenyl)-1-(cyclopenta-1,4-diene-1-carbonyl)-3,10-dihydro-2H-imidazo[2,1-g][1,7]naphthyridin-5-one;10a-(4-chlorophenyl)-1-(2-methyl-1,3-thiazole-4-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one;bis(10a-(4-chlorophenyl)-1-(3-methylthiophene-2-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one);1-(3-chlorobenzoyl)-10a-(4-chlorophenyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one is Cc1ccsc1C(=O)N1CCN2C(=O)c3cccnc3CC21c1ccc(Cl)cc1.Cc1ccsc1C(=O)N1CCN2C(=O)c3cccnc3CC21c1ccc(Cl)cc1.Cc1nc(C(=O)N2CCN3C(=O)c4cccnc4CC23c2ccc(Cl)cc2)cs1.O=C(C1=CCC=C1)N1CCN2C(=O)c3ncccc3CC12c1ccc(Cl)cc1.O=C(c1cccc(Cl)c1)N1CCN2C(=O)c3cccnc3CC12c1ccc(Cl)cc1.

What is the InChIKey of 10a-(4-chlorophenyl)-1-(cyclopenta-1,4-diene-1-carbonyl)-3,10-dihydro-2H-imidazo[2,1-g][1,7]naphthyridin-5-one;10a-(4-chlorophenyl)-1-(2-methyl-1,3-thiazole-4-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one;bis(10a-(4-chlorophenyl)-1-(3-methylthiophene-2-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one);1-(3-chlorobenzoyl)-10a-(4-chlorophenyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one?

The InChIKey is SYSLWBZKYBVDDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17Cl2N3O2.2C22H18ClN3O2S.C22H18ClN3O2.C21H17ClN4O2S/c24-17-8-6-16(7-9-17)23-14-20-19(5-2-10-26-20)22(30)28(23)12-11-27(23)21(29)15-3-1-4-18(25)13-15;2*1-14-8-12-29-19(14)21(28)26-11-10-25-20(27)17-3-2-9-24-18(17)13-22(25,26)15-4-6-16(23)7-5-15;23-18-9-7-17(8-10-18)22-14-16-6-3-11-24-19(16)21(28)26(22)13-12-25(22)20(27)15-4-1-2-5-15;1-13-24-18(12-29-13)20(28)26-10-9-25-19(27)16-3-2-8-23-17(16)11-21(25,26)14-4-6-15(22)7-5-14/h1-10,13H,11-12,14H2;2*2-9,12H,10-11,13H2,1H3;1,3-11H,2,12-14H2;2-8,12H,9-11H2,1H3.

What are the key properties of 10a-(4-chlorophenyl)-1-(cyclopenta-1,4-diene-1-carbonyl)-3,10-dihydro-2H-imidazo[2,1-g][1,7]naphthyridin-5-one;10a-(4-chlorophenyl)-1-(2-methyl-1,3-thiazole-4-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one;bis(10a-(4-chlorophenyl)-1-(3-methylthiophene-2-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one);1-(3-chlorobenzoyl)-10a-(4-chlorophenyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one?

10a-(4-chlorophenyl)-1-(cyclopenta-1,4-diene-1-carbonyl)-3,10-dihydro-2H-imidazo[2,1-g][1,7]naphthyridin-5-one;10a-(4-chlorophenyl)-1-(2-methyl-1,3-thiazole-4-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one;bis(10a-(4-chlorophenyl)-1-(3-methylthiophene-2-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one);1-(3-chlorobenzoyl)-10a-(4-chlorophenyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one has a molecular weight of 2102.93 g/mol, XLogP of 19.44, 10 rotatable bonds, 0 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for 10a-(4-chlorophenyl)-1-(cyclopenta-1,4-diene-1-carbonyl)-3,10-dihydro-2H-imidazo[2,1-g][1,7]naphthyridin-5-one;10a-(4-chlorophenyl)-1-(2-methyl-1,3-thiazole-4-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one;bis(10a-(4-chlorophenyl)-1-(3-methylthiophene-2-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one);1-(3-chlorobenzoyl)-10a-(4-chlorophenyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one is sourced from PubChem (CID 160974856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).