N-naphthalen-2-yl-4-piperazin-1-ylnaphthalene-1-sulfonamide

C24H23N3O2S — CID 10226081

IUPACN-naphthalen-2-yl-4-piperazin-1-ylnaphthalene-1-sulfonamide
SMILESO=S(=O)(Nc1ccc2ccccc2c1)c1ccc(N2CCNCC2)c2ccccc12
InChIInChI=1S/C24H23N3O2S/c28-30(29,26-20-10-9-18-5-1-2-6-19(18)17-20)24-12-11-23(27-15-13-25-14-16-27)21-7-3-4-8-22(21)24/h1-12,17,25-26H,13-16H2
InChIKeyQNQFAAZASWWFAT-UHFFFAOYSA-N
MW417.53 g/mol
LogP4.20
Rot. Bonds4

About N-naphthalen-2-yl-4-piperazin-1-ylnaphthalene-1-sulfonamide

N-naphthalen-2-yl-4-piperazin-1-ylnaphthalene-1-sulfonamide (PubChem CID 10226081) has the molecular formula C24H23N3O2S and a molecular weight of 417.53 g/mol. Its IUPAC name is N-naphthalen-2-yl-4-piperazin-1-ylnaphthalene-1-sulfonamide.

Molecular Properties

Compound NameN-naphthalen-2-yl-4-piperazin-1-ylnaphthalene-1-sulfonamide
PubChem CID10226081
Molecular FormulaC24H23N3O2S
Molecular Weight417.53 g/mol
Exact Mass417.15
IUPAC NameN-naphthalen-2-yl-4-piperazin-1-ylnaphthalene-1-sulfonamide
SMILESO=S(=O)(Nc1ccc2ccccc2c1)c1ccc(N2CCNCC2)c2ccccc12
InChIInChI=1S/C24H23N3O2S/c28-30(29,26-20-10-9-18-5-1-2-6-19(18)17-20)24-12-11-23(27-15-13-25-14-16-27)21-7-3-4-8-22(21)24/h1-12,17,25-26H,13-16H2
InChIKeyQNQFAAZASWWFAT-UHFFFAOYSA-N
XLogP4.20
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500417.53
LogP ≤ 54.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(1,4-diazepan-1-yl)-N-(4-methylphenyl)naphthalene-1-sulfonamide
CID 10159893
2,4-dichloro-N-(4-piperazin-1-ylnaphthalen-1-yl)benzenesulfonamide
CID 10277045
2-methyl-N-naphthalen-2-yl-1,3-dioxobenzo[de]isoquinoline-6-sulfonamide
CID 75366563
2,5-dichloro-N-(4-piperazin-1-ylnaphthalen-1-yl)benzenesulfonamide;hydrochloride
CID 10116267
1-hydroxy-4-(naphthalen-2-ylsulfamoyl)naphthalene-2-carboxylic acid
CID 126480781
N-(4-methoxyphenyl)-N-methyl-4-piperazin-1-ylnaphthalene-1-sulfonamide;hydrochloride
CID 10225702
N-(3-chlorophenyl)-4-[(3R,5S)-3,5-dimethylpiperazin-1-yl]naphthalene-1-sulfonamide
CID 10162035
1-naphthalen-2-ylsulfonyl-4-piperazin-1-ylindole;dihydrochloride
CID 10183265
3-amino-N-phenyl-4-piperazin-1-ylbenzenesulfonamide
CID 22272481
5-(benzenesulfonamido)-N-benzyl-2-piperazin-1-ylbenzamide
CID 50822911
5-[(2-fluorophenyl)sulfonylamino]-N,N-bis(2-methylpropyl)-2-piperazin-1-ylbenzamide
CID 46379655
5-chloro-N-(4-piperazin-1-ylquinolin-6-yl)naphthalene-2-sulfonamide;hydrochloride
CID 44533514

Frequently Asked Questions

What is the IUPAC name of N-naphthalen-2-yl-4-piperazin-1-ylnaphthalene-1-sulfonamide?
The IUPAC name of N-naphthalen-2-yl-4-piperazin-1-ylnaphthalene-1-sulfonamide (CID 10226081) is N-naphthalen-2-yl-4-piperazin-1-ylnaphthalene-1-sulfonamide.
What is the SMILES notation for N-naphthalen-2-yl-4-piperazin-1-ylnaphthalene-1-sulfonamide?
The canonical SMILES for N-naphthalen-2-yl-4-piperazin-1-ylnaphthalene-1-sulfonamide is O=S(=O)(Nc1ccc2ccccc2c1)c1ccc(N2CCNCC2)c2ccccc12.
What is the InChIKey of N-naphthalen-2-yl-4-piperazin-1-ylnaphthalene-1-sulfonamide?
The InChIKey is QNQFAAZASWWFAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O2S/c28-30(29,26-20-10-9-18-5-1-2-6-19(18)17-20)24-12-11-23(27-15-13-25-14-16-27)21-7-3-4-8-22(21)24/h1-12,17,25-26H,13-16H2.
What are the key properties of N-naphthalen-2-yl-4-piperazin-1-ylnaphthalene-1-sulfonamide?
N-naphthalen-2-yl-4-piperazin-1-ylnaphthalene-1-sulfonamide has a molecular weight of 417.53 g/mol, XLogP of 4.20, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-2-yl-4-piperazin-1-ylnaphthalene-1-sulfonamide is sourced from PubChem (CID 10226081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).