4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;1-[2-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]ethyl]-2,3-dihydrotetrazol-5-amine;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;2,10-difluoro-6-methoxy-5,7-dimethylindolo[2,3-b]carbazole;2,10-difluoro-6-methoxy-12-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole;ethyl 2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carboxylate

C133H106F15N21O8 — CID 160944985

IUPAC4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;1-[2-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]ethyl]-2,3-dihydrotetrazol-5-amine;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;2,10-difluoro-6-methoxy-5,7-dimethylindolo[2,3-b]carbazole;2,10-difluoro-6-methoxy-12-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole;ethyl 2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carboxylate
SMILESCC(C)/N=C(\N)CCCOc1c2[nH]c3ccc(F)cc3c2cc2c1[nH]c1ccc(F)cc12.CCOC(=O)c1c2c([nH]c3ccc(F)cc32)c(OC)c2[nH]c3ccc(F)cc3c12.COc1c2[nH]c3ccc(F)cc3c2c(C(F)(F)F)c2c1[nH]c1ccc(F)cc12.COc1c2c(cc3c4cc(F)ccc4n(C)c13)c1cc(F)ccc1n2C.NC1=NNNN1CCOc1c2[nH]c3ccc(F)cc3c2cc2c1[nH]c1ccc(F)cc12.[H]/N=C(/CCCOc1c2[nH]c3ccc(F)cc3c2cc2c1[nH]c1ccc(F)cc12)N(C)C
InChIInChI=1S/C25H24F2N4O.C24H22F2N4O.C22H16F2N2O3.C21H17F2N7O.C21H16F2N2O.C20H11F5N2O/c1-13(2)29-22(28)4-3-9-32-25-23-18(16-10-14(26)5-7-20(16)30-23)12-19-17-11-15(27)6-8-21(17)31-24(19)25;1-30(2)21(27)4-3-9-31-24-22-17(15-10-13(25)5-7-19(15)28-22)12-18-16-11-14(26)6-8-20(16)29-23(18)24;1-3-29-22(27)18-16-12-8-10(23)4-6-14(12)25-19(16)21(28-2)20-17(18)13-9-11(24)5-7-15(13)26-20;22-10-1-3-16-12(7-10)14-9-15-13-8-11(23)2-4-17(13)26-19(15)20(18(14)25-16)31-6-5-30-21(24)27-28-29-30;1-24-17-6-4-11(22)8-13(17)15-10-16-14-9-12(23)5-7-18(14)25(2)20(16)21(26-3)19(15)24;1-28-19-17-14(10-6-8(21)2-4-12(10)26-17)16(20(23,24)25)15-11-7-9(22)3-5-13(11)27-18(15)19/h5-8,10-13,30-31H,3-4,9H2,1-2H3,(H2,28,29);5-8,10-12,27-29H,3-4,9H2,1-2H3;4-9,25-26H,3H2,1-2H3;1-4,7-9,25-26,28-29H,5-6H2,(H2,24,27);4-10H,1-3H3;2-7,26-27H,1H3/b;27-21-;;;;
InChIKeySUZNABRNGCMIED-PSHWVXRDSA-N
MW2411.42 g/mol
LogP32.20
Rot. Bonds20

About 4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;1-[2-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]ethyl]-2,3-dihydrotetrazol-5-amine;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;2,10-difluoro-6-methoxy-5,7-dimethylindolo[2,3-b]carbazole;2,10-difluoro-6-methoxy-12-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole;ethyl 2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carboxylate

4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;1-[2-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]ethyl]-2,3-dihydrotetrazol-5-amine;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;2,10-difluoro-6-methoxy-5,7-dimethylindolo[2,3-b]carbazole;2,10-difluoro-6-methoxy-12-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole;ethyl 2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carboxylate (PubChem CID 160944985) has the molecular formula C133H106F15N21O8 and a molecular weight of 2411.42 g/mol. Its IUPAC name is 4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;1-[2-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]ethyl]-2,3-dihydrotetrazol-5-amine;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;2,10-difluoro-6-methoxy-5,7-dimethylindolo[2,3-b]carbazole;2,10-difluoro-6-methoxy-12-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole;ethyl 2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carboxylate.

Molecular Properties

Compound Name4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;1-[2-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]ethyl]-2,3-dihydrotetrazol-5-amine;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;2,10-difluoro-6-methoxy-5,7-dimethylindolo[2,3-b]carbazole;2,10-difluoro-6-methoxy-12-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole;ethyl 2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carboxylate
PubChem CID160944985
Molecular FormulaC133H106F15N21O8
Molecular Weight2411.42 g/mol
Exact Mass2409.83
IUPAC Name4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;1-[2-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]ethyl]-2,3-dihydrotetrazol-5-amine;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;2,10-difluoro-6-methoxy-5,7-dimethylindolo[2,3-b]carbazole;2,10-difluoro-6-methoxy-12-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole;ethyl 2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carboxylate
SMILESCC(C)/N=C(\N)CCCOc1c2[nH]c3ccc(F)cc3c2cc2c1[nH]c1ccc(F)cc12.CCOC(=O)c1c2c([nH]c3ccc(F)cc32)c(OC)c2[nH]c3ccc(F)cc3c12.COc1c2[nH]c3ccc(F)cc3c2c(C(F)(F)F)c2c1[nH]c1ccc(F)cc12.COc1c2c(cc3c4cc(F)ccc4n(C)c13)c1cc(F)ccc1n2C.NC1=NNNN1CCOc1c2[nH]c3ccc(F)cc3c2cc2c1[nH]c1ccc(F)cc12.[H]/N=C(/CCCOc1c2[nH]c3ccc(F)cc3c2cc2c1[nH]c1ccc(F)cc12)N(C)C
InChIInChI=1S/C25H24F2N4O.C24H22F2N4O.C22H16F2N2O3.C21H17F2N7O.C21H16F2N2O.C20H11F5N2O/c1-13(2)29-22(28)4-3-9-32-25-23-18(16-10-14(26)5-7-20(16)30-23)12-19-17-11-15(27)6-8-21(17)31-24(19)25;1-30(2)21(27)4-3-9-31-24-22-17(15-10-13(25)5-7-19(15)28-22)12-18-16-11-14(26)6-8-20(16)29-23(18)24;1-3-29-22(27)18-16-12-8-10(23)4-6-14(12)25-19(16)21(28-2)20-17(18)13-9-11(24)5-7-15(13)26-20;22-10-1-3-16-12(7-10)14-9-15-13-8-11(23)2-4-17(13)26-19(15)20(18(14)25-16)31-6-5-30-21(24)27-28-29-30;1-24-17-6-4-11(22)8-13(17)15-10-16-14-9-12(23)5-7-18(14)25(2)20(16)21(26-3)19(15)24;1-28-19-17-14(10-6-8(21)2-4-12(10)26-17)16(20(23,24)25)15-11-7-9(22)3-5-13(11)27-18(15)19/h5-8,10-13,30-31H,3-4,9H2,1-2H3,(H2,28,29);5-8,10-12,27-29H,3-4,9H2,1-2H3;4-9,25-26H,3H2,1-2H3;1-4,7-9,25-26,28-29H,5-6H2,(H2,24,27);4-10H,1-3H3;2-7,26-27H,1H3/b;27-21-;;;;
InChIKeySUZNABRNGCMIED-PSHWVXRDSA-N
XLogP32.20
TPSA380.59 Ų
H-Bond Donors15
H-Bond Acceptors17
Rotatable Bonds20
Heavy Atoms177
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002411.42
LogP ≤ 532.20
H-Bond Donors ≤ 515
H-Bond Acceptors ≤ 1017

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze 4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;1-[2-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]ethyl]-2,3-dihydrotetrazol-5-amine;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;2,10-difluoro-6-methoxy-5,7-dimethylindolo[2,3-b]carbazole;2,10-difluoro-6-methoxy-12-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole;ethyl 2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carboxylate with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;1-[2-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]ethyl]-2,3-dihydrotetrazol-5-amine;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;2,10-difluoro-6-methoxy-5,7-dimethylindolo[2,3-b]carbazole;2,10-difluoro-6-methoxy-12-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole;ethyl 2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carboxylate?
The IUPAC name of 4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;1-[2-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]ethyl]-2,3-dihydrotetrazol-5-amine;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;2,10-difluoro-6-methoxy-5,7-dimethylindolo[2,3-b]carbazole;2,10-difluoro-6-methoxy-12-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole;ethyl 2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carboxylate (CID 160944985) is 4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;1-[2-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]ethyl]-2,3-dihydrotetrazol-5-amine;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;2,10-difluoro-6-methoxy-5,7-dimethylindolo[2,3-b]carbazole;2,10-difluoro-6-methoxy-12-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole;ethyl 2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carboxylate.
What is the SMILES notation for 4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;1-[2-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]ethyl]-2,3-dihydrotetrazol-5-amine;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;2,10-difluoro-6-methoxy-5,7-dimethylindolo[2,3-b]carbazole;2,10-difluoro-6-methoxy-12-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole;ethyl 2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carboxylate?
The canonical SMILES for 4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;1-[2-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]ethyl]-2,3-dihydrotetrazol-5-amine;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;2,10-difluoro-6-methoxy-5,7-dimethylindolo[2,3-b]carbazole;2,10-difluoro-6-methoxy-12-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole;ethyl 2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carboxylate is CC(C)/N=C(\N)CCCOc1c2[nH]c3ccc(F)cc3c2cc2c1[nH]c1ccc(F)cc12.CCOC(=O)c1c2c([nH]c3ccc(F)cc32)c(OC)c2[nH]c3ccc(F)cc3c12.COc1c2[nH]c3ccc(F)cc3c2c(C(F)(F)F)c2c1[nH]c1ccc(F)cc12.COc1c2c(cc3c4cc(F)ccc4n(C)c13)c1cc(F)ccc1n2C.NC1=NNNN1CCOc1c2[nH]c3ccc(F)cc3c2cc2c1[nH]c1ccc(F)cc12.[H]/N=C(/CCCOc1c2[nH]c3ccc(F)cc3c2cc2c1[nH]c1ccc(F)cc12)N(C)C.
What is the InChIKey of 4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;1-[2-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]ethyl]-2,3-dihydrotetrazol-5-amine;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;2,10-difluoro-6-methoxy-5,7-dimethylindolo[2,3-b]carbazole;2,10-difluoro-6-methoxy-12-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole;ethyl 2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carboxylate?
The InChIKey is SUZNABRNGCMIED-PSHWVXRDSA-N. The full InChI is InChI=1S/C25H24F2N4O.C24H22F2N4O.C22H16F2N2O3.C21H17F2N7O.C21H16F2N2O.C20H11F5N2O/c1-13(2)29-22(28)4-3-9-32-25-23-18(16-10-14(26)5-7-20(16)30-23)12-19-17-11-15(27)6-8-21(17)31-24(19)25;1-30(2)21(27)4-3-9-31-24-22-17(15-10-13(25)5-7-19(15)28-22)12-18-16-11-14(26)6-8-20(16)29-23(18)24;1-3-29-22(27)18-16-12-8-10(23)4-6-14(12)25-19(16)21(28-2)20-17(18)13-9-11(24)5-7-15(13)26-20;22-10-1-3-16-12(7-10)14-9-15-13-8-11(23)2-4-17(13)26-19(15)20(18(14)25-16)31-6-5-30-21(24)27-28-29-30;1-24-17-6-4-11(22)8-13(17)15-10-16-14-9-12(23)5-7-18(14)25(2)20(16)21(26-3)19(15)24;1-28-19-17-14(10-6-8(21)2-4-12(10)26-17)16(20(23,24)25)15-11-7-9(22)3-5-13(11)27-18(15)19/h5-8,10-13,30-31H,3-4,9H2,1-2H3,(H2,28,29);5-8,10-12,27-29H,3-4,9H2,1-2H3;4-9,25-26H,3H2,1-2H3;1-4,7-9,25-26,28-29H,5-6H2,(H2,24,27);4-10H,1-3H3;2-7,26-27H,1H3/b;27-21-;;;;.
What are the key properties of 4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;1-[2-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]ethyl]-2,3-dihydrotetrazol-5-amine;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;2,10-difluoro-6-methoxy-5,7-dimethylindolo[2,3-b]carbazole;2,10-difluoro-6-methoxy-12-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole;ethyl 2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carboxylate?
4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;1-[2-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]ethyl]-2,3-dihydrotetrazol-5-amine;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;2,10-difluoro-6-methoxy-5,7-dimethylindolo[2,3-b]carbazole;2,10-difluoro-6-methoxy-12-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole;ethyl 2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carboxylate has a molecular weight of 2411.42 g/mol, XLogP of 32.20, 20 rotatable bonds, 15 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;1-[2-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]ethyl]-2,3-dihydrotetrazol-5-amine;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;2,10-difluoro-6-methoxy-5,7-dimethylindolo[2,3-b]carbazole;2,10-difluoro-6-methoxy-12-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole;ethyl 2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carboxylate is sourced from PubChem (CID 160944985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).