N-[4-(phenylsulfamoyl)naphthalen-1-yl]benzamide

C23H18N2O3S — CID 11774008

IUPACN-[4-(phenylsulfamoyl)naphthalen-1-yl]benzamide
SMILESO=C(Nc1ccc(S(=O)(=O)Nc2ccccc2)c2ccccc12)c1ccccc1
InChIInChI=1S/C23H18N2O3S/c26-23(17-9-3-1-4-10-17)24-21-15-16-22(20-14-8-7-13-19(20)21)29(27,28)25-18-11-5-2-6-12-18/h1-16,25H,(H,24,26)
InChIKeyWLKYPFNFQJMVGH-UHFFFAOYSA-N
MW402.48 g/mol
LogP4.89
Rot. Bonds5

About N-[4-(phenylsulfamoyl)naphthalen-1-yl]benzamide

N-[4-(phenylsulfamoyl)naphthalen-1-yl]benzamide (PubChem CID 11774008) has the molecular formula C23H18N2O3S and a molecular weight of 402.48 g/mol. Its IUPAC name is N-[4-(phenylsulfamoyl)naphthalen-1-yl]benzamide.

Molecular Properties

Compound NameN-[4-(phenylsulfamoyl)naphthalen-1-yl]benzamide
PubChem CID11774008
Molecular FormulaC23H18N2O3S
Molecular Weight402.48 g/mol
Exact Mass402.10
IUPAC NameN-[4-(phenylsulfamoyl)naphthalen-1-yl]benzamide
SMILESO=C(Nc1ccc(S(=O)(=O)Nc2ccccc2)c2ccccc12)c1ccccc1
InChIInChI=1S/C23H18N2O3S/c26-23(17-9-3-1-4-10-17)24-21-15-16-22(20-14-8-7-13-19(20)21)29(27,28)25-18-11-5-2-6-12-18/h1-16,25H,(H,24,26)
InChIKeyWLKYPFNFQJMVGH-UHFFFAOYSA-N
XLogP4.89
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.48
LogP ≤ 54.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,2'-Dithiobis-(N-(4-sulfamoylphenyl)-benzamide)
CID 375084
NF023
CID 6093160
8-({3-[({3-[(4,6,8-Trisulfonaphthalen-1-yl)carbamoyl]phenyl}carbamoyl)amino]benzoyl}amino)naphthalene-1,3,5-trisulfonic acid
CID 4466
N-cyclohexyl-1-ethyl-2-oxo-1,2-dihydrobenzo[cd]indole-6-sulfonamide
CID 1192817
N-{4-[(benzylamino)sulfonyl]-1-naphthyl}benzamide
CID 11270007
2-methyl-N-{4-[({1-[(2S)-pyrrolidin-2-ylcarbonyl]piperidin-4-yl}amino)sulfonyl]-1-naphthyl}benzamide
CID 10006907
4-(4-Benzoylamino-naphthalene-1-sulfonylamino)-piperidine-1-carboxylic acid ethyl ester
CID 10367938
N-(4-{[(1-butyrylpiperidin-4-yl)amino]sulfonyl}-1-naphthyl)-2-methylbenzamide
CID 10391001
4-[4-(2-Methyl-benzoylamino)-naphthalene-1-sulfonylamino]-piperidine-1-carboxylic acid methylamide
CID 11754900
N,N-diethyl-6-oxo-5,6-dihydrophenanthridine-2-sulfonamide
CID 6324455
N4-Acetyl-N1-(1-naphthyl)sulfanilamide
CID 306209
NF023 (hexasodium)
CID 4465

Frequently Asked Questions

What is the IUPAC name of N-[4-(phenylsulfamoyl)naphthalen-1-yl]benzamide?
The IUPAC name of N-[4-(phenylsulfamoyl)naphthalen-1-yl]benzamide (CID 11774008) is N-[4-(phenylsulfamoyl)naphthalen-1-yl]benzamide.
What is the SMILES notation for N-[4-(phenylsulfamoyl)naphthalen-1-yl]benzamide?
The canonical SMILES for N-[4-(phenylsulfamoyl)naphthalen-1-yl]benzamide is O=C(Nc1ccc(S(=O)(=O)Nc2ccccc2)c2ccccc12)c1ccccc1.
What is the InChIKey of N-[4-(phenylsulfamoyl)naphthalen-1-yl]benzamide?
The InChIKey is WLKYPFNFQJMVGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N2O3S/c26-23(17-9-3-1-4-10-17)24-21-15-16-22(20-14-8-7-13-19(20)21)29(27,28)25-18-11-5-2-6-12-18/h1-16,25H,(H,24,26).
What are the key properties of N-[4-(phenylsulfamoyl)naphthalen-1-yl]benzamide?
N-[4-(phenylsulfamoyl)naphthalen-1-yl]benzamide has a molecular weight of 402.48 g/mol, XLogP of 4.89, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(phenylsulfamoyl)naphthalen-1-yl]benzamide is sourced from PubChem (CID 11774008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).