6-[(6-chloro-3H-benzimidazol-5-yl)methyl]-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;6-[(2-chloro-1,8-naphthyridin-3-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;2-(dimethylamino)ethyl 6-[[2-[3-(dimethylamino)-2-oxopropyl]quinolin-4-yl]methyl]-4-fluoro-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylate;6-[[2-[3-(dimethylamino)-2-oxopropyl]quinolin-4-yl]methyl]-4-fluoro-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(6-fluoro-1H-indazol-5-yl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;methane

C144H121Cl2F5N18O22 — CID 159438192

About 6-[(6-chloro-3H-benzimidazol-5-yl)methyl]-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;6-[(2-chloro-1,8-naphthyridin-3-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;2-(dimethylamino)ethyl 6-[[2-[3-(dimethylamino)-2-oxopropyl]quinolin-4-yl]methyl]-4-fluoro-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylate;6-[[2-[3-(dimethylamino)-2-oxopropyl]quinolin-4-yl]methyl]-4-fluoro-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(6-fluoro-1H-indazol-5-yl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;methane

6-[(6-chloro-3H-benzimidazol-5-yl)methyl]-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;6-[(2-chloro-1,8-naphthyridin-3-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;2-(dimethylamino)ethyl 6-[[2-[3-(dimethylamino)-2-oxopropyl]quinolin-4-yl]methyl]-4-fluoro-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylate;6-[[2-[3-(dimethylamino)-2-oxopropyl]quinolin-4-yl]methyl]-4-fluoro-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(6-fluoro-1H-indazol-5-yl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;methane (PubChem CID 159438192) has the molecular formula C144H121Cl2F5N18O22 and a molecular weight of 2621.55 g/mol. Its IUPAC name is 6-[(6-chloro-3H-benzimidazol-5-yl)methyl]-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;6-[(2-chloro-1,8-naphthyridin-3-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;2-(dimethylamino)ethyl 6-[[2-[3-(dimethylamino)-2-oxopropyl]quinolin-4-yl]methyl]-4-fluoro-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylate;6-[[2-[3-(dimethylamino)-2-oxopropyl]quinolin-4-yl]methyl]-4-fluoro-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(6-fluoro-1H-indazol-5-yl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;methane.

Molecular Properties

• Compound Name: 6-[(6-chloro-3H-benzimidazol-5-yl)methyl]-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;6-[(2-chloro-1,8-naphthyridin-3-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;2-(dimethylamino)ethyl 6-[[2-[3-(dimethylamino)-2-oxopropyl]quinolin-4-yl]methyl]-4-fluoro-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylate;6-[[2-[3-(dimethylamino)-2-oxopropyl]quinolin-4-yl]methyl]-4-fluoro-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(6-fluoro-1H-indazol-5-yl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;methane
• PubChem CID: 159438192
• Molecular Formula: C144H121Cl2F5N18O22
• Molecular Weight: 2621.55 g/mol
• Exact Mass: 2618.82
• IUPAC Name: 6-[(6-chloro-3H-benzimidazol-5-yl)methyl]-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;6-[(2-chloro-1,8-naphthyridin-3-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;2-(dimethylamino)ethyl 6-[[2-[3-(dimethylamino)-2-oxopropyl]quinolin-4-yl]methyl]-4-fluoro-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylate;6-[[2-[3-(dimethylamino)-2-oxopropyl]quinolin-4-yl]methyl]-4-fluoro-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(6-fluoro-1H-indazol-5-yl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;methane
• SMILES: C.C.CN(C)CC(=O)Cc1cc(Cn2c(C(=O)O)c(C3=CC=CCC3=O)c3c4c(c(F)cc32)CCO4)c2ccccc2n1.CN(C)CCOC(=O)c1c(C2=CC=CCC2=O)c2c3c(c(F)cc2n1Cc1cc(CC(=O)CN(C)C)nc2ccccc12)CCO3.O=C(O)c1c(-c2ccc[nH]c2=O)c2c3c(c(F)cc2n1Cc1cc2cccnc2nc1Cl)CCO3.O=C(O)c1c(-c2ccc[nH]c2=O)c2c3occc3c(F)cc2n1Cc1cc2cn[nH]c2cc1F.O=C1CC=CC=C1c1c(C(=O)O)n(Cc2cc3[nH]cnc3cc2Cl)c2ccc3c(c12)OCC3
• InChI: InChI=1S/C36H37FN4O5.C32H28FN3O5.C25H16ClFN4O4.C25H18ClN3O4.C24H14F2N4O4.2CH4/c1-39(2)14-16-46-36(44)34-32(27-10-6-8-12-31(27)43)33-30(19-28(37)26-13-15-45-35(26)33)41(34)20-22-17-23(18-24(42)21-40(3)4)38-29-11-7-5-9-25(22)29;1-35(2)17-20(37)14-19-13-18(21-7-3-5-9-25(21)34-19)16-36-26-15-24(33)22-11-12-41-31(22)29(26)28(30(36)32(39)40)23-8-4-6-10-27(23)38;26-22-13(9-12-3-1-6-28-23(12)30-22)11-31-17-10-16(27)14-5-8-35-21(14)19(17)18(20(31)25(33)34)15-4-2-7-29-24(15)32;26-16-10-18-17(27-12-28-18)9-14(16)11-29-19-6-5-13-7-8-33-24(13)22(19)21(23(29)25(31)32)15-3-1-2-4-20(15)30;25-15-7-17-11(9-28-29-17)6-12(15)10-30-18-8-16(26)13-3-5-34-22(13)20(18)19(21(30)24(32)33)14-2-1-4-27-23(14)31;;/h5-11,17,19H,12-16,18,20-21H2,1-4H3;3-9,13,15H,10-12,14,16-17H2,1-2H3,(H,39,40);1-4,6-7,9-10H,5,8,11H2,(H,29,32)(H,33,34);1-3,5-6,9-10,12H,4,7-8,11H2,(H,27,28)(H,31,32);1-9H,10H2,(H,27,31)(H,28,29)(H,32,33);2*1H4
• InChIKey: LRVNELGIKXXKSH-UHFFFAOYSA-N
• XLogP: 24.31
• TPSA: 519.92 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 32
• Rotatable Bonds: 31
• Heavy Atoms: 191
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2621.55
LogP ≤ 5	24.31
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	32

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 6-[(6-chloro-3H-benzimidazol-5-yl)methyl]-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;6-[(2-chloro-1,8-naphthyridin-3-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;2-(dimethylamino)ethyl 6-[[2-[3-(dimethylamino)-2-oxopropyl]quinolin-4-yl]methyl]-4-fluoro-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylate;6-[[2-[3-(dimethylamino)-2-oxopropyl]quinolin-4-yl]methyl]-4-fluoro-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(6-fluoro-1H-indazol-5-yl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;methane?

The IUPAC name of 6-[(6-chloro-3H-benzimidazol-5-yl)methyl]-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;6-[(2-chloro-1,8-naphthyridin-3-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;2-(dimethylamino)ethyl 6-[[2-[3-(dimethylamino)-2-oxopropyl]quinolin-4-yl]methyl]-4-fluoro-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylate;6-[[2-[3-(dimethylamino)-2-oxopropyl]quinolin-4-yl]methyl]-4-fluoro-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(6-fluoro-1H-indazol-5-yl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;methane (CID 159438192) is 6-[(6-chloro-3H-benzimidazol-5-yl)methyl]-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;6-[(2-chloro-1,8-naphthyridin-3-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;2-(dimethylamino)ethyl 6-[[2-[3-(dimethylamino)-2-oxopropyl]quinolin-4-yl]methyl]-4-fluoro-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylate;6-[[2-[3-(dimethylamino)-2-oxopropyl]quinolin-4-yl]methyl]-4-fluoro-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(6-fluoro-1H-indazol-5-yl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;methane.

What is the SMILES notation for 6-[(6-chloro-3H-benzimidazol-5-yl)methyl]-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;6-[(2-chloro-1,8-naphthyridin-3-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;2-(dimethylamino)ethyl 6-[[2-[3-(dimethylamino)-2-oxopropyl]quinolin-4-yl]methyl]-4-fluoro-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylate;6-[[2-[3-(dimethylamino)-2-oxopropyl]quinolin-4-yl]methyl]-4-fluoro-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(6-fluoro-1H-indazol-5-yl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;methane?

The canonical SMILES for 6-[(6-chloro-3H-benzimidazol-5-yl)methyl]-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;6-[(2-chloro-1,8-naphthyridin-3-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;2-(dimethylamino)ethyl 6-[[2-[3-(dimethylamino)-2-oxopropyl]quinolin-4-yl]methyl]-4-fluoro-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylate;6-[[2-[3-(dimethylamino)-2-oxopropyl]quinolin-4-yl]methyl]-4-fluoro-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(6-fluoro-1H-indazol-5-yl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;methane is C.C.CN(C)CC(=O)Cc1cc(Cn2c(C(=O)O)c(C3=CC=CCC3=O)c3c4c(c(F)cc32)CCO4)c2ccccc2n1.CN(C)CCOC(=O)c1c(C2=CC=CCC2=O)c2c3c(c(F)cc2n1Cc1cc(CC(=O)CN(C)C)nc2ccccc12)CCO3.O=C(O)c1c(-c2ccc[nH]c2=O)c2c3c(c(F)cc2n1Cc1cc2cccnc2nc1Cl)CCO3.O=C(O)c1c(-c2ccc[nH]c2=O)c2c3occc3c(F)cc2n1Cc1cc2cn[nH]c2cc1F.O=C1CC=CC=C1c1c(C(=O)O)n(Cc2cc3[nH]cnc3cc2Cl)c2ccc3c(c12)OCC3.

What is the InChIKey of 6-[(6-chloro-3H-benzimidazol-5-yl)methyl]-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;6-[(2-chloro-1,8-naphthyridin-3-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;2-(dimethylamino)ethyl 6-[[2-[3-(dimethylamino)-2-oxopropyl]quinolin-4-yl]methyl]-4-fluoro-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylate;6-[[2-[3-(dimethylamino)-2-oxopropyl]quinolin-4-yl]methyl]-4-fluoro-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(6-fluoro-1H-indazol-5-yl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;methane?

The InChIKey is LRVNELGIKXXKSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H37FN4O5.C32H28FN3O5.C25H16ClFN4O4.C25H18ClN3O4.C24H14F2N4O4.2CH4/c1-39(2)14-16-46-36(44)34-32(27-10-6-8-12-31(27)43)33-30(19-28(37)26-13-15-45-35(26)33)41(34)20-22-17-23(18-24(42)21-40(3)4)38-29-11-7-5-9-25(22)29;1-35(2)17-20(37)14-19-13-18(21-7-3-5-9-25(21)34-19)16-36-26-15-24(33)22-11-12-41-31(22)29(26)28(30(36)32(39)40)23-8-4-6-10-27(23)38;26-22-13(9-12-3-1-6-28-23(12)30-22)11-31-17-10-16(27)14-5-8-35-21(14)19(17)18(20(31)25(33)34)15-4-2-7-29-24(15)32;26-16-10-18-17(27-12-28-18)9-14(16)11-29-19-6-5-13-7-8-33-24(13)22(19)21(23(29)25(31)32)15-3-1-2-4-20(15)30;25-15-7-17-11(9-28-29-17)6-12(15)10-30-18-8-16(26)13-3-5-34-22(13)20(18)19(21(30)24(32)33)14-2-1-4-27-23(14)31;;/h5-11,17,19H,12-16,18,20-21H2,1-4H3;3-9,13,15H,10-12,14,16-17H2,1-2H3,(H,39,40);1-4,6-7,9-10H,5,8,11H2,(H,29,32)(H,33,34);1-3,5-6,9-10,12H,4,7-8,11H2,(H,27,28)(H,31,32);1-9H,10H2,(H,27,31)(H,28,29)(H,32,33);2*1H4.

What are the key properties of 6-[(6-chloro-3H-benzimidazol-5-yl)methyl]-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;6-[(2-chloro-1,8-naphthyridin-3-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;2-(dimethylamino)ethyl 6-[[2-[3-(dimethylamino)-2-oxopropyl]quinolin-4-yl]methyl]-4-fluoro-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylate;6-[[2-[3-(dimethylamino)-2-oxopropyl]quinolin-4-yl]methyl]-4-fluoro-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(6-fluoro-1H-indazol-5-yl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;methane?

6-[(6-chloro-3H-benzimidazol-5-yl)methyl]-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;6-[(2-chloro-1,8-naphthyridin-3-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;2-(dimethylamino)ethyl 6-[[2-[3-(dimethylamino)-2-oxopropyl]quinolin-4-yl]methyl]-4-fluoro-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylate;6-[[2-[3-(dimethylamino)-2-oxopropyl]quinolin-4-yl]methyl]-4-fluoro-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(6-fluoro-1H-indazol-5-yl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;methane has a molecular weight of 2621.55 g/mol, XLogP of 24.31, 31 rotatable bonds, 8 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for 6-[(6-chloro-3H-benzimidazol-5-yl)methyl]-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;6-[(2-chloro-1,8-naphthyridin-3-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;2-(dimethylamino)ethyl 6-[[2-[3-(dimethylamino)-2-oxopropyl]quinolin-4-yl]methyl]-4-fluoro-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylate;6-[[2-[3-(dimethylamino)-2-oxopropyl]quinolin-4-yl]methyl]-4-fluoro-8-(6-oxocyclohexa-1,3-dien-1-yl)-2,3-dihydrofuro[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(6-fluoro-1H-indazol-5-yl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;methane is sourced from PubChem (CID 159438192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).