N-[1-[1-(4-fluorophenyl)indazol-5-yl]oxy-3-phenylpropan-2-yl]pyridine-3-sulfonamide

C27H23FN4O3S — CID 90910282

IUPACN-[1-[1-(4-fluorophenyl)indazol-5-yl]oxy-3-phenylpropan-2-yl]pyridine-3-sulfonamide
SMILESO=S(=O)(NC(COc1ccc2c(cnn2-c2ccc(F)cc2)c1)Cc1ccccc1)c1cccnc1
InChIInChI=1S/C27H23FN4O3S/c28-22-8-10-24(11-9-22)32-27-13-12-25(16-21(27)17-30-32)35-19-23(15-20-5-2-1-3-6-20)31-36(33,34)26-7-4-14-29-18-26/h1-14,16-18,23,31H,15,19H2
InChIKeyNWUHFNDNRWOIFX-UHFFFAOYSA-N
MW502.57 g/mol
LogP4.53
Rot. Bonds9

About N-[1-[1-(4-fluorophenyl)indazol-5-yl]oxy-3-phenylpropan-2-yl]pyridine-3-sulfonamide

N-[1-[1-(4-fluorophenyl)indazol-5-yl]oxy-3-phenylpropan-2-yl]pyridine-3-sulfonamide (PubChem CID 90910282) has the molecular formula C27H23FN4O3S and a molecular weight of 502.57 g/mol. Its IUPAC name is N-[1-[1-(4-fluorophenyl)indazol-5-yl]oxy-3-phenylpropan-2-yl]pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-[1-[1-(4-fluorophenyl)indazol-5-yl]oxy-3-phenylpropan-2-yl]pyridine-3-sulfonamide
PubChem CID90910282
Molecular FormulaC27H23FN4O3S
Molecular Weight502.57 g/mol
Exact Mass502.15
IUPAC NameN-[1-[1-(4-fluorophenyl)indazol-5-yl]oxy-3-phenylpropan-2-yl]pyridine-3-sulfonamide
SMILESO=S(=O)(NC(COc1ccc2c(cnn2-c2ccc(F)cc2)c1)Cc1ccccc1)c1cccnc1
InChIInChI=1S/C27H23FN4O3S/c28-22-8-10-24(11-9-22)32-27-13-12-25(16-21(27)17-30-32)35-19-23(15-20-5-2-1-3-6-20)31-36(33,34)26-7-4-14-29-18-26/h1-14,16-18,23,31H,15,19H2
InChIKeyNWUHFNDNRWOIFX-UHFFFAOYSA-N
XLogP4.53
TPSA86.11 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500502.57
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[1-[1-(4-fluorophenyl)indazol-5-yl]oxy-3-phenylpropan-2-yl]pyridine-3-sulfonamide 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

N-[1-[1-(4-fluorophenyl)indazol-5-yl]oxy-3-phenylpropan-2-yl]methanesulfonamide
CID 91585554
N-[1-[1-(4-fluorophenyl)indazol-5-yl]oxy-3-phenylpropan-2-yl]ethanesulfonamide
CID 91439728
N-[(1S,2S)-1-[1-(4-fluorophenyl)indazol-5-yl]oxy-1-phenylpropan-2-yl]pyridine-3-sulfonamide
CID 66687701
N-ethylsulfanyl-1-[1-(4-fluorophenyl)indazol-5-yl]oxypropan-2-amine
CID 143677612
2,2,2-trifluoro-N-[1-[1-(4-fluorophenyl)indazol-5-yl]oxy-1-phenylpropan-2-yl]ethanesulfonamide
CID 74372625
N-[(1R,2S)-1-[1-(4-fluorophenyl)indazol-5-yl]oxy-1-phenylpropan-2-yl]-3-(4-methoxyphenoxy)propane-1-sulfonamide
CID 24953516
N-[(1R,2S)-1-[1-(4-fluorophenyl)indazol-5-yl]oxy-1-phenylpropan-2-yl]-1-methylimidazole-4-sulfonamide
CID 59786590
N-[4-bromo-1-(4-fluorophenyl)pyrazol-5-yl]pyridine-3-sulfonamide
CID 167773950
1-cyclopentyl-N-[(1R,2S)-1-[1-(4-fluorophenyl)indazol-5-yl]oxy-1-phenylpropan-2-yl]methanesulfonamide
CID 59786562
N-[1-[1-(4-fluorophenyl)indazol-5-yl]oxy-1-(3-methoxyphenyl)propan-2-yl]-4-nitrobenzenesulfonamide
CID 78015242
2-fluoro-N-[(1S,2S)-1-[1-(4-fluorophenyl)indazol-5-yl]oxy-1-phenylpropan-2-yl]acetamide
CID 66812455
(1R,2S)-1-[1-(4-fluorophenyl)indazol-5-yl]oxy-1-phenylbutan-2-amine
CID 59339729

Frequently Asked Questions

What is the IUPAC name of N-[1-[1-(4-fluorophenyl)indazol-5-yl]oxy-3-phenylpropan-2-yl]pyridine-3-sulfonamide?
The IUPAC name of N-[1-[1-(4-fluorophenyl)indazol-5-yl]oxy-3-phenylpropan-2-yl]pyridine-3-sulfonamide (CID 90910282) is N-[1-[1-(4-fluorophenyl)indazol-5-yl]oxy-3-phenylpropan-2-yl]pyridine-3-sulfonamide.
What is the SMILES notation for N-[1-[1-(4-fluorophenyl)indazol-5-yl]oxy-3-phenylpropan-2-yl]pyridine-3-sulfonamide?
The canonical SMILES for N-[1-[1-(4-fluorophenyl)indazol-5-yl]oxy-3-phenylpropan-2-yl]pyridine-3-sulfonamide is O=S(=O)(NC(COc1ccc2c(cnn2-c2ccc(F)cc2)c1)Cc1ccccc1)c1cccnc1.
What is the InChIKey of N-[1-[1-(4-fluorophenyl)indazol-5-yl]oxy-3-phenylpropan-2-yl]pyridine-3-sulfonamide?
The InChIKey is NWUHFNDNRWOIFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H23FN4O3S/c28-22-8-10-24(11-9-22)32-27-13-12-25(16-21(27)17-30-32)35-19-23(15-20-5-2-1-3-6-20)31-36(33,34)26-7-4-14-29-18-26/h1-14,16-18,23,31H,15,19H2.
What are the key properties of N-[1-[1-(4-fluorophenyl)indazol-5-yl]oxy-3-phenylpropan-2-yl]pyridine-3-sulfonamide?
N-[1-[1-(4-fluorophenyl)indazol-5-yl]oxy-3-phenylpropan-2-yl]pyridine-3-sulfonamide has a molecular weight of 502.57 g/mol, XLogP of 4.53, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[1-(4-fluorophenyl)indazol-5-yl]oxy-3-phenylpropan-2-yl]pyridine-3-sulfonamide is sourced from PubChem (CID 90910282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).