N-(4-hydroxynaphthalen-1-yl)-N-(2-phenyl-1H-indol-3-yl)naphthalene-1-sulfonamide

C34H24N2O3S — CID 171341751

IUPACN-(4-hydroxynaphthalen-1-yl)-N-(2-phenyl-1H-indol-3-yl)naphthalene-1-sulfonamide
SMILESO=S(=O)(c1cccc2ccccc12)N(c1c(-c2ccccc2)[nH]c2ccccc12)c1ccc(O)c2ccccc12
InChIInChI=1S/C34H24N2O3S/c37-31-22-21-30(26-16-6-7-17-27(26)31)36(40(38,39)32-20-10-14-23-11-4-5-15-25(23)32)34-28-18-8-9-19-29(28)35-33(34)24-12-2-1-3-13-24/h1-22,35,37H
InChIKeyMCAJOJPODDCOIH-UHFFFAOYSA-N
MW540.64 g/mol
LogP8.37
Rot. Bonds5

About N-(4-hydroxynaphthalen-1-yl)-N-(2-phenyl-1H-indol-3-yl)naphthalene-1-sulfonamide

N-(4-hydroxynaphthalen-1-yl)-N-(2-phenyl-1H-indol-3-yl)naphthalene-1-sulfonamide (PubChem CID 171341751) has the molecular formula C34H24N2O3S and a molecular weight of 540.64 g/mol. Its IUPAC name is N-(4-hydroxynaphthalen-1-yl)-N-(2-phenyl-1H-indol-3-yl)naphthalene-1-sulfonamide.

Molecular Properties

Compound NameN-(4-hydroxynaphthalen-1-yl)-N-(2-phenyl-1H-indol-3-yl)naphthalene-1-sulfonamide
PubChem CID171341751
Molecular FormulaC34H24N2O3S
Molecular Weight540.64 g/mol
Exact Mass540.15
IUPAC NameN-(4-hydroxynaphthalen-1-yl)-N-(2-phenyl-1H-indol-3-yl)naphthalene-1-sulfonamide
SMILESO=S(=O)(c1cccc2ccccc12)N(c1c(-c2ccccc2)[nH]c2ccccc12)c1ccc(O)c2ccccc12
InChIInChI=1S/C34H24N2O3S/c37-31-22-21-30(26-16-6-7-17-27(26)31)36(40(38,39)32-20-10-14-23-11-4-5-15-25(23)32)34-28-18-8-9-19-29(28)35-33(34)24-12-2-1-3-13-24/h1-22,35,37H
InChIKeyMCAJOJPODDCOIH-UHFFFAOYSA-N
XLogP8.37
TPSA73.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500540.64
LogP ≤ 58.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(4-hydroxynaphthalen-1-yl)-N-(2-phenyl-1H-indol-3-yl)naphthalene-1-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-(4-hydroxynaphthalen-1-yl)-4-methyl-N-(6-methyl-2-phenyl-1H-indol-3-yl)benzenesulfonamide
CID 171341744
N-(4-hydroxynaphthalen-1-yl)-N-(2-phenyl-1H-indol-3-yl)acetamide
CID 171341762
N-(4-anilinonaphthalen-1-yl)-4-methyl-N-(2-phenyl-1H-indol-3-yl)benzenesulfonamide
CID 171341743
N-benzyl-5-hydroxy-N-methylnaphthalene-1-sulfonamide
CID 10215206
N-(2-hydroxypropyl)-N-methylnaphthalene-1-sulfonamide
CID 115902788
N-(6-aminohexyl)-N-chloronaphthalene-1-sulfonamide
CID 139649368
N-methyl-N-propan-2-ylnaphthalene-1-sulfonamide
CID 21131549
2-(4-methylpiperazine-1,4-diium-1-yl)-1-(2-phenyl-1H-indol-3-yl)ethanone
CID 6997322
naphthalene-1-sulfonic acid
CID 158712346
2-[[methyl(naphthalen-1-ylsulfonyl)amino]methyl]-1H-benzimidazole-4-carboxylic acid
CID 58101843
4-[methyl(naphthalen-1-ylsulfonyl)amino]butanoic acid
CID 115776536
ethyl 3-[(4-aminonaphthalen-1-yl)-(4-methylphenyl)sulfonylamino]-1H-indole-2-carboxylate
CID 171341776

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxynaphthalen-1-yl)-N-(2-phenyl-1H-indol-3-yl)naphthalene-1-sulfonamide?
The IUPAC name of N-(4-hydroxynaphthalen-1-yl)-N-(2-phenyl-1H-indol-3-yl)naphthalene-1-sulfonamide (CID 171341751) is N-(4-hydroxynaphthalen-1-yl)-N-(2-phenyl-1H-indol-3-yl)naphthalene-1-sulfonamide.
What is the SMILES notation for N-(4-hydroxynaphthalen-1-yl)-N-(2-phenyl-1H-indol-3-yl)naphthalene-1-sulfonamide?
The canonical SMILES for N-(4-hydroxynaphthalen-1-yl)-N-(2-phenyl-1H-indol-3-yl)naphthalene-1-sulfonamide is O=S(=O)(c1cccc2ccccc12)N(c1c(-c2ccccc2)[nH]c2ccccc12)c1ccc(O)c2ccccc12.
What is the InChIKey of N-(4-hydroxynaphthalen-1-yl)-N-(2-phenyl-1H-indol-3-yl)naphthalene-1-sulfonamide?
The InChIKey is MCAJOJPODDCOIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H24N2O3S/c37-31-22-21-30(26-16-6-7-17-27(26)31)36(40(38,39)32-20-10-14-23-11-4-5-15-25(23)32)34-28-18-8-9-19-29(28)35-33(34)24-12-2-1-3-13-24/h1-22,35,37H.
What are the key properties of N-(4-hydroxynaphthalen-1-yl)-N-(2-phenyl-1H-indol-3-yl)naphthalene-1-sulfonamide?
N-(4-hydroxynaphthalen-1-yl)-N-(2-phenyl-1H-indol-3-yl)naphthalene-1-sulfonamide has a molecular weight of 540.64 g/mol, XLogP of 8.37, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxynaphthalen-1-yl)-N-(2-phenyl-1H-indol-3-yl)naphthalene-1-sulfonamide is sourced from PubChem (CID 171341751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).