6-[(3-amino-6-fluoro-1H-indazol-5-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;6-[(2-amino-4-pyridinyl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(2-fluorophenyl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-8-(2-oxo-1H-pyridin-3-yl)-6-[(2-oxo-1H-pyridin-4-yl)methyl]furo[2,3-e]indole-7-carboxylic acid

C91H58F6N14O17 — CID 157317597

IUPAC6-[(3-amino-6-fluoro-1H-indazol-5-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;6-[(2-amino-4-pyridinyl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(2-fluorophenyl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-8-(2-oxo-1H-pyridin-3-yl)-6-[(2-oxo-1H-pyridin-4-yl)methyl]furo[2,3-e]indole-7-carboxylic acid
SMILESNc1cc(Cn2c(C(=O)O)c(-c3ccc[nH]c3=O)c3c4occc4c(F)cc32)ccn1.Nc1n[nH]c2cc(F)c(Cn3c(C(=O)O)c(-c4ccc[nH]c4=O)c4c5occc5c(F)cc43)cc12.O=C(O)c1c(-c2ccc[nH]c2=O)c2c3occc3c(F)cc2n1Cc1cc[nH]c(=O)c1.O=C(O)c1c(-c2ccc[nH]c2=O)c2c3occc3c(F)cc2n1Cc1ccccc1F
InChIInChI=1S/C24H15F2N5O4.C23H14F2N2O4.C22H15FN4O4.C22H14FN3O5/c25-14-7-16-13(22(27)30-29-16)6-10(14)9-31-17-8-15(26)11-3-5-35-21(11)19(17)18(20(31)24(33)34)12-2-1-4-28-23(12)32;24-15-6-2-1-4-12(15)11-27-17-10-16(25)13-7-9-31-21(13)19(17)18(20(27)23(29)30)14-5-3-8-26-22(14)28;23-14-9-15-18(20-12(14)4-7-31-20)17(13-2-1-5-26-21(13)28)19(22(29)30)27(15)10-11-3-6-25-16(24)8-11;23-14-9-15-18(20-12(14)4-7-31-20)17(13-2-1-5-25-21(13)28)19(22(29)30)26(15)10-11-3-6-24-16(27)8-11/h1-8H,9H2,(H,28,32)(H,33,34)(H3,27,29,30);1-10H,11H2,(H,26,28)(H,29,30);1-9H,10H2,(H2,24,25)(H,26,28)(H,29,30);1-9H,10H2,(H,24,27)(H,25,28)(H,29,30)
InChIKeyBDUGHEQJWRYGMH-UHFFFAOYSA-N
MW1733.53 g/mol
LogP15.92
Rot. Bonds16

About 6-[(3-amino-6-fluoro-1H-indazol-5-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;6-[(2-amino-4-pyridinyl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(2-fluorophenyl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-8-(2-oxo-1H-pyridin-3-yl)-6-[(2-oxo-1H-pyridin-4-yl)methyl]furo[2,3-e]indole-7-carboxylic acid

6-[(3-amino-6-fluoro-1H-indazol-5-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;6-[(2-amino-4-pyridinyl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(2-fluorophenyl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-8-(2-oxo-1H-pyridin-3-yl)-6-[(2-oxo-1H-pyridin-4-yl)methyl]furo[2,3-e]indole-7-carboxylic acid (PubChem CID 157317597) has the molecular formula C91H58F6N14O17 and a molecular weight of 1733.53 g/mol. Its IUPAC name is 6-[(3-amino-6-fluoro-1H-indazol-5-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;6-[(2-amino-4-pyridinyl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(2-fluorophenyl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-8-(2-oxo-1H-pyridin-3-yl)-6-[(2-oxo-1H-pyridin-4-yl)methyl]furo[2,3-e]indole-7-carboxylic acid.

Molecular Properties

Compound Name6-[(3-amino-6-fluoro-1H-indazol-5-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;6-[(2-amino-4-pyridinyl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(2-fluorophenyl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-8-(2-oxo-1H-pyridin-3-yl)-6-[(2-oxo-1H-pyridin-4-yl)methyl]furo[2,3-e]indole-7-carboxylic acid
PubChem CID157317597
Molecular FormulaC91H58F6N14O17
Molecular Weight1733.53 g/mol
Exact Mass1732.40
IUPAC Name6-[(3-amino-6-fluoro-1H-indazol-5-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;6-[(2-amino-4-pyridinyl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(2-fluorophenyl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-8-(2-oxo-1H-pyridin-3-yl)-6-[(2-oxo-1H-pyridin-4-yl)methyl]furo[2,3-e]indole-7-carboxylic acid
SMILESNc1cc(Cn2c(C(=O)O)c(-c3ccc[nH]c3=O)c3c4occc4c(F)cc32)ccn1.Nc1n[nH]c2cc(F)c(Cn3c(C(=O)O)c(-c4ccc[nH]c4=O)c4c5occc5c(F)cc43)cc12.O=C(O)c1c(-c2ccc[nH]c2=O)c2c3occc3c(F)cc2n1Cc1cc[nH]c(=O)c1.O=C(O)c1c(-c2ccc[nH]c2=O)c2c3occc3c(F)cc2n1Cc1ccccc1F
InChIInChI=1S/C24H15F2N5O4.C23H14F2N2O4.C22H15FN4O4.C22H14FN3O5/c25-14-7-16-13(22(27)30-29-16)6-10(14)9-31-17-8-15(26)11-3-5-35-21(11)19(17)18(20(31)24(33)34)12-2-1-4-28-23(12)32;24-15-6-2-1-4-12(15)11-27-17-10-16(25)13-7-9-31-21(13)19(17)18(20(27)23(29)30)14-5-3-8-26-22(14)28;23-14-9-15-18(20-12(14)4-7-31-20)17(13-2-1-5-26-21(13)28)19(22(29)30)27(15)10-11-3-6-25-16(24)8-11;23-14-9-15-18(20-12(14)4-7-31-20)17(13-2-1-5-25-21(13)28)19(22(29)30)26(15)10-11-3-6-24-16(27)8-11/h1-8H,9H2,(H,28,32)(H,33,34)(H3,27,29,30);1-10H,11H2,(H,26,28)(H,29,30);1-9H,10H2,(H2,24,25)(H,26,28)(H,29,30);1-9H,10H2,(H,24,27)(H,25,28)(H,29,30)
InChIKeyBDUGHEQJWRYGMH-UHFFFAOYSA-N
XLogP15.92
TPSA479.39 Ų
H-Bond Donors12
H-Bond Acceptors21
Rotatable Bonds16
Heavy Atoms128
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001733.53
LogP ≤ 515.92
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1021

Analyze 6-[(3-amino-6-fluoro-1H-indazol-5-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;6-[(2-amino-4-pyridinyl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(2-fluorophenyl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-8-(2-oxo-1H-pyridin-3-yl)-6-[(2-oxo-1H-pyridin-4-yl)methyl]furo[2,3-e]indole-7-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-[(3-amino-6-fluoro-1H-indazol-5-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid
CID 44547929
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
CID 44548902
6-[(3-amino-5-fluoro-1H-indazol-6-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid
CID 44548908
6-[(3-amino-6-fluoro-1-methyl-indazol-5-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid
CID 68263795
4-fluoro-6-[(6-methyl-1H-indazol-5-yl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid
CID 68263855
2-(dimethylamino)ethyl 4-fluoro-6-[(6-fluoro-1H-indazol-5-yl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylate;2,2,2-trifluoroacetic acid
CID 73057096
2-(dimethylamino)ethyl 6-[(3-amino-6-fluoro-1H-indazol-5-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylate;2,2,2-trifluoroacetic acid
CID 73058275
2-(dimethylamino)ethyl 4-fluoro-6-[(6-methyl-1H-indazol-5-yl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylate;2,2,2-trifluoroacetic acid
CID 73058276
2-dimethylaminoethyl 4-fluoro-6-[(6-fluoro-1H-indazol-5-yl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylate
CID 44548747
2-dimethylaminoethyl 6-[(3-amino-6-fluoro-1H-indazol-5-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylate
CID 68263641
6-[(3-amino-1-tert-butoxycarbonyl-indazol-5-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid
CID 25173148
6-[(2-amino-4-pyridyl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid
CID 49774143

Frequently Asked Questions

What is the IUPAC name of 6-[(3-amino-6-fluoro-1H-indazol-5-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;6-[(2-amino-4-pyridinyl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(2-fluorophenyl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-8-(2-oxo-1H-pyridin-3-yl)-6-[(2-oxo-1H-pyridin-4-yl)methyl]furo[2,3-e]indole-7-carboxylic acid?
The IUPAC name of 6-[(3-amino-6-fluoro-1H-indazol-5-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;6-[(2-amino-4-pyridinyl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(2-fluorophenyl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-8-(2-oxo-1H-pyridin-3-yl)-6-[(2-oxo-1H-pyridin-4-yl)methyl]furo[2,3-e]indole-7-carboxylic acid (CID 157317597) is 6-[(3-amino-6-fluoro-1H-indazol-5-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;6-[(2-amino-4-pyridinyl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(2-fluorophenyl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-8-(2-oxo-1H-pyridin-3-yl)-6-[(2-oxo-1H-pyridin-4-yl)methyl]furo[2,3-e]indole-7-carboxylic acid.
What is the SMILES notation for 6-[(3-amino-6-fluoro-1H-indazol-5-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;6-[(2-amino-4-pyridinyl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(2-fluorophenyl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-8-(2-oxo-1H-pyridin-3-yl)-6-[(2-oxo-1H-pyridin-4-yl)methyl]furo[2,3-e]indole-7-carboxylic acid?
The canonical SMILES for 6-[(3-amino-6-fluoro-1H-indazol-5-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;6-[(2-amino-4-pyridinyl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(2-fluorophenyl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-8-(2-oxo-1H-pyridin-3-yl)-6-[(2-oxo-1H-pyridin-4-yl)methyl]furo[2,3-e]indole-7-carboxylic acid is Nc1cc(Cn2c(C(=O)O)c(-c3ccc[nH]c3=O)c3c4occc4c(F)cc32)ccn1.Nc1n[nH]c2cc(F)c(Cn3c(C(=O)O)c(-c4ccc[nH]c4=O)c4c5occc5c(F)cc43)cc12.O=C(O)c1c(-c2ccc[nH]c2=O)c2c3occc3c(F)cc2n1Cc1cc[nH]c(=O)c1.O=C(O)c1c(-c2ccc[nH]c2=O)c2c3occc3c(F)cc2n1Cc1ccccc1F.
What is the InChIKey of 6-[(3-amino-6-fluoro-1H-indazol-5-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;6-[(2-amino-4-pyridinyl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(2-fluorophenyl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-8-(2-oxo-1H-pyridin-3-yl)-6-[(2-oxo-1H-pyridin-4-yl)methyl]furo[2,3-e]indole-7-carboxylic acid?
The InChIKey is BDUGHEQJWRYGMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H15F2N5O4.C23H14F2N2O4.C22H15FN4O4.C22H14FN3O5/c25-14-7-16-13(22(27)30-29-16)6-10(14)9-31-17-8-15(26)11-3-5-35-21(11)19(17)18(20(31)24(33)34)12-2-1-4-28-23(12)32;24-15-6-2-1-4-12(15)11-27-17-10-16(25)13-7-9-31-21(13)19(17)18(20(27)23(29)30)14-5-3-8-26-22(14)28;23-14-9-15-18(20-12(14)4-7-31-20)17(13-2-1-5-26-21(13)28)19(22(29)30)27(15)10-11-3-6-25-16(24)8-11;23-14-9-15-18(20-12(14)4-7-31-20)17(13-2-1-5-25-21(13)28)19(22(29)30)26(15)10-11-3-6-24-16(27)8-11/h1-8H,9H2,(H,28,32)(H,33,34)(H3,27,29,30);1-10H,11H2,(H,26,28)(H,29,30);1-9H,10H2,(H2,24,25)(H,26,28)(H,29,30);1-9H,10H2,(H,24,27)(H,25,28)(H,29,30).
What are the key properties of 6-[(3-amino-6-fluoro-1H-indazol-5-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;6-[(2-amino-4-pyridinyl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(2-fluorophenyl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-8-(2-oxo-1H-pyridin-3-yl)-6-[(2-oxo-1H-pyridin-4-yl)methyl]furo[2,3-e]indole-7-carboxylic acid?
6-[(3-amino-6-fluoro-1H-indazol-5-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;6-[(2-amino-4-pyridinyl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(2-fluorophenyl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-8-(2-oxo-1H-pyridin-3-yl)-6-[(2-oxo-1H-pyridin-4-yl)methyl]furo[2,3-e]indole-7-carboxylic acid has a molecular weight of 1733.53 g/mol, XLogP of 15.92, 16 rotatable bonds, 12 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(3-amino-6-fluoro-1H-indazol-5-yl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;6-[(2-amino-4-pyridinyl)methyl]-4-fluoro-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(2-fluorophenyl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-8-(2-oxo-1H-pyridin-3-yl)-6-[(2-oxo-1H-pyridin-4-yl)methyl]furo[2,3-e]indole-7-carboxylic acid is sourced from PubChem (CID 157317597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).