N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]cyclopropanecarboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]furan-2-carboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]methanesulfonamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]oxolane-2-carboxamide;(2S)-N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;N-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)methanesulfonamide

C113H83F6N19O11S7 — CID 159723218

IUPACN-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]cyclopropanecarboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]furan-2-carboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]methanesulfonamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]oxolane-2-carboxamide;(2S)-N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;N-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)methanesulfonamide
SMILESCS(=O)(=O)Nc1ccc2[nH]nc(-c3cc4ccccc4s3)c2c1F.CS(=O)(=O)Nc1ccc2[nH]nc(-c3ccc4ccccc4c3)c2c1F.O=C(Nc1ccc2[nH]nc(-c3cc4ccccc4s3)c2c1F)C1CC1.O=C(Nc1ccc2[nH]nc(-c3cc4ccccc4s3)c2c1F)C1CCCO1.O=C(Nc1ccc2[nH]nc(-c3cc4ccccc4s3)c2c1F)c1ccco1.O=C1CC[C@@H](C(=O)Nc2ccc3[nH]nc(-c4cc5ccccc5s4)c3c2F)N1
InChIInChI=1S/C20H15FN4O2S.C20H16FN3O2S.C20H12FN3O2S.C19H14FN3OS.C18H14FN3O2S.C16H12FN3O2S2/c21-18-12(23-20(27)13-7-8-16(26)22-13)6-5-11-17(18)19(25-24-11)15-9-10-3-1-2-4-14(10)28-15;2*21-18-13(22-20(25)14-5-3-9-26-14)8-7-12-17(18)19(24-23-12)16-10-11-4-1-2-6-15(11)27-16;20-17-13(21-19(24)10-5-6-10)8-7-12-16(17)18(23-22-12)15-9-11-3-1-2-4-14(11)25-15;1-25(23,24)22-15-9-8-14-16(17(15)19)18(21-20-14)13-7-6-11-4-2-3-5-12(11)10-13;1-24(21,22)20-11-7-6-10-14(15(11)17)16(19-18-10)13-8-9-4-2-3-5-12(9)23-13/h1-6,9,13H,7-8H2,(H,22,26)(H,23,27)(H,24,25);1-2,4,6-8,10,14H,3,5,9H2,(H,22,25)(H,23,24);1-10H,(H,22,25)(H,23,24);1-4,7-10H,5-6H2,(H,21,24)(H,22,23);2-10,22H,1H3,(H,20,21);2-8,20H,1H3,(H,18,19)/t13-;;;;;/m0...../s1
InChIKeyNAHPKXHXISNBKA-VFZNITTPSA-N
MW2221.49 g/mol
LogP26.71
Rot. Bonds18

About N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]cyclopropanecarboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]furan-2-carboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]methanesulfonamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]oxolane-2-carboxamide;(2S)-N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;N-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)methanesulfonamide

N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]cyclopropanecarboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]furan-2-carboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]methanesulfonamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]oxolane-2-carboxamide;(2S)-N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;N-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)methanesulfonamide (PubChem CID 159723218) has the molecular formula C113H83F6N19O11S7 and a molecular weight of 2221.49 g/mol. Its IUPAC name is N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]cyclopropanecarboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]furan-2-carboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]methanesulfonamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]oxolane-2-carboxamide;(2S)-N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;N-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)methanesulfonamide.

Molecular Properties

Compound NameN-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]cyclopropanecarboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]furan-2-carboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]methanesulfonamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]oxolane-2-carboxamide;(2S)-N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;N-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)methanesulfonamide
PubChem CID159723218
Molecular FormulaC113H83F6N19O11S7
Molecular Weight2221.49 g/mol
Exact Mass2219.45
IUPAC NameN-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]cyclopropanecarboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]furan-2-carboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]methanesulfonamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]oxolane-2-carboxamide;(2S)-N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;N-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)methanesulfonamide
SMILESCS(=O)(=O)Nc1ccc2[nH]nc(-c3cc4ccccc4s3)c2c1F.CS(=O)(=O)Nc1ccc2[nH]nc(-c3ccc4ccccc4c3)c2c1F.O=C(Nc1ccc2[nH]nc(-c3cc4ccccc4s3)c2c1F)C1CC1.O=C(Nc1ccc2[nH]nc(-c3cc4ccccc4s3)c2c1F)C1CCCO1.O=C(Nc1ccc2[nH]nc(-c3cc4ccccc4s3)c2c1F)c1ccco1.O=C1CC[C@@H](C(=O)Nc2ccc3[nH]nc(-c4cc5ccccc5s4)c3c2F)N1
InChIInChI=1S/C20H15FN4O2S.C20H16FN3O2S.C20H12FN3O2S.C19H14FN3OS.C18H14FN3O2S.C16H12FN3O2S2/c21-18-12(23-20(27)13-7-8-16(26)22-13)6-5-11-17(18)19(25-24-11)15-9-10-3-1-2-4-14(10)28-15;2*21-18-13(22-20(25)14-5-3-9-26-14)8-7-12-17(18)19(24-23-12)16-10-11-4-1-2-6-15(11)27-16;20-17-13(21-19(24)10-5-6-10)8-7-12-16(17)18(23-22-12)15-9-11-3-1-2-4-14(11)25-15;1-25(23,24)22-15-9-8-14-16(17(15)19)18(21-20-14)13-7-6-11-4-2-3-5-12(11)10-13;1-24(21,22)20-11-7-6-10-14(15(11)17)16(19-18-10)13-8-9-4-2-3-5-12(9)23-13/h1-6,9,13H,7-8H2,(H,22,26)(H,23,27)(H,24,25);1-2,4,6-8,10,14H,3,5,9H2,(H,22,25)(H,23,24);1-10H,(H,22,25)(H,23,24);1-4,7-10H,5-6H2,(H,21,24)(H,22,23);2-10,22H,1H3,(H,20,21);2-8,20H,1H3,(H,18,19)/t13-;;;;;/m0...../s1
InChIKeyNAHPKXHXISNBKA-VFZNITTPSA-N
XLogP26.71
TPSA432.29 Ų
H-Bond Donors13
H-Bond Acceptors22
Rotatable Bonds18
Heavy Atoms156
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002221.49
LogP ≤ 526.71
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1022

Analyze N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]cyclopropanecarboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]furan-2-carboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]methanesulfonamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]oxolane-2-carboxamide;(2S)-N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;N-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)methanesulfonamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]cyclopropanecarboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]furan-2-carboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]methanesulfonamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]oxolane-2-carboxamide;(2S)-N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;N-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)methanesulfonamide?
The IUPAC name of N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]cyclopropanecarboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]furan-2-carboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]methanesulfonamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]oxolane-2-carboxamide;(2S)-N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;N-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)methanesulfonamide (CID 159723218) is N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]cyclopropanecarboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]furan-2-carboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]methanesulfonamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]oxolane-2-carboxamide;(2S)-N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;N-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)methanesulfonamide.
What is the SMILES notation for N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]cyclopropanecarboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]furan-2-carboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]methanesulfonamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]oxolane-2-carboxamide;(2S)-N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;N-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)methanesulfonamide?
The canonical SMILES for N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]cyclopropanecarboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]furan-2-carboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]methanesulfonamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]oxolane-2-carboxamide;(2S)-N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;N-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)methanesulfonamide is CS(=O)(=O)Nc1ccc2[nH]nc(-c3cc4ccccc4s3)c2c1F.CS(=O)(=O)Nc1ccc2[nH]nc(-c3ccc4ccccc4c3)c2c1F.O=C(Nc1ccc2[nH]nc(-c3cc4ccccc4s3)c2c1F)C1CC1.O=C(Nc1ccc2[nH]nc(-c3cc4ccccc4s3)c2c1F)C1CCCO1.O=C(Nc1ccc2[nH]nc(-c3cc4ccccc4s3)c2c1F)c1ccco1.O=C1CC[C@@H](C(=O)Nc2ccc3[nH]nc(-c4cc5ccccc5s4)c3c2F)N1.
What is the InChIKey of N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]cyclopropanecarboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]furan-2-carboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]methanesulfonamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]oxolane-2-carboxamide;(2S)-N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;N-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)methanesulfonamide?
The InChIKey is NAHPKXHXISNBKA-VFZNITTPSA-N. The full InChI is InChI=1S/C20H15FN4O2S.C20H16FN3O2S.C20H12FN3O2S.C19H14FN3OS.C18H14FN3O2S.C16H12FN3O2S2/c21-18-12(23-20(27)13-7-8-16(26)22-13)6-5-11-17(18)19(25-24-11)15-9-10-3-1-2-4-14(10)28-15;2*21-18-13(22-20(25)14-5-3-9-26-14)8-7-12-17(18)19(24-23-12)16-10-11-4-1-2-6-15(11)27-16;20-17-13(21-19(24)10-5-6-10)8-7-12-16(17)18(23-22-12)15-9-11-3-1-2-4-14(11)25-15;1-25(23,24)22-15-9-8-14-16(17(15)19)18(21-20-14)13-7-6-11-4-2-3-5-12(11)10-13;1-24(21,22)20-11-7-6-10-14(15(11)17)16(19-18-10)13-8-9-4-2-3-5-12(9)23-13/h1-6,9,13H,7-8H2,(H,22,26)(H,23,27)(H,24,25);1-2,4,6-8,10,14H,3,5,9H2,(H,22,25)(H,23,24);1-10H,(H,22,25)(H,23,24);1-4,7-10H,5-6H2,(H,21,24)(H,22,23);2-10,22H,1H3,(H,20,21);2-8,20H,1H3,(H,18,19)/t13-;;;;;/m0...../s1.
What are the key properties of N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]cyclopropanecarboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]furan-2-carboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]methanesulfonamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]oxolane-2-carboxamide;(2S)-N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;N-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)methanesulfonamide?
N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]cyclopropanecarboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]furan-2-carboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]methanesulfonamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]oxolane-2-carboxamide;(2S)-N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;N-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)methanesulfonamide has a molecular weight of 2221.49 g/mol, XLogP of 26.71, 18 rotatable bonds, 13 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]cyclopropanecarboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]furan-2-carboxamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]methanesulfonamide;N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]oxolane-2-carboxamide;(2S)-N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;N-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)methanesulfonamide is sourced from PubChem (CID 159723218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).