7-hydroxy-1-N,3-N-diphenylnaphthalene-1,3-disulfonamide

C22H18N2O5S2 — CID 1376755

IUPAC7-hydroxy-1-N,3-N-diphenylnaphthalene-1,3-disulfonamide
SMILESO=S(=O)(Nc1ccccc1)c1cc(S(=O)(=O)Nc2ccccc2)c2cc(O)ccc2c1
InChIInChI=1S/C22H18N2O5S2/c25-19-12-11-16-13-20(30(26,27)23-17-7-3-1-4-8-17)15-22(21(16)14-19)31(28,29)24-18-9-5-2-6-10-18/h1-15,23-25H
InChIKeyAZWLEOHSTMDFSZ-UHFFFAOYSA-N
MW454.53 g/mol
LogP4.15
Rot. Bonds6

About 7-hydroxy-1-N,3-N-diphenylnaphthalene-1,3-disulfonamide

7-hydroxy-1-N,3-N-diphenylnaphthalene-1,3-disulfonamide (PubChem CID 1376755) has the molecular formula C22H18N2O5S2 and a molecular weight of 454.53 g/mol. Its IUPAC name is 7-hydroxy-1-N,3-N-diphenylnaphthalene-1,3-disulfonamide.

Molecular Properties

Compound Name7-hydroxy-1-N,3-N-diphenylnaphthalene-1,3-disulfonamide
PubChem CID1376755
Molecular FormulaC22H18N2O5S2
Molecular Weight454.53 g/mol
Exact Mass454.07
IUPAC Name7-hydroxy-1-N,3-N-diphenylnaphthalene-1,3-disulfonamide
SMILESO=S(=O)(Nc1ccccc1)c1cc(S(=O)(=O)Nc2ccccc2)c2cc(O)ccc2c1
InChIInChI=1S/C22H18N2O5S2/c25-19-12-11-16-13-20(30(26,27)23-17-7-3-1-4-8-17)15-22(21(16)14-19)31(28,29)24-18-9-5-2-6-10-18/h1-15,23-25H
InChIKeyAZWLEOHSTMDFSZ-UHFFFAOYSA-N
XLogP4.15
TPSA112.57 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500454.53
LogP ≤ 54.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

7-hydroxy-1-N,3-N-bis(3-methylphenyl)naphthalene-1,3-disulfonamide
CID 86634474
7-hydroxy-1-N,3-N-bis(3,4,5-trichlorophenyl)naphthalene-1,3-disulfonamide
CID 86634480
1-N,3-N-bis(3-chloro-2-fluorophenyl)-7-hydroxynaphthalene-1,3-disulfonamide
CID 86634483
6-amino-4-hydroxy-N-phenylnaphthalene-2-sulfonamide
CID 163888329
3-chloro-5-hydroxy-N-phenylbenzenesulfonamide
CID 70056195
7-hydroxynaphthalene-1,3-disulfonyl chloride
CID 86634467
N-(3-hydroxyphenyl)-4-iodobenzenesulfonamide
CID 4254070
1-hydroxy-4-(phenylsulfamoyl)naphthalene-2-carboxylic acid
CID 126480790
7-hydroxy-3-[[5-[[3-[(6-hydroxy-4-sulfonaphthalen-2-yl)sulfamoyl]-4-methylphenyl]carbamoylamino]-2-methylphenyl]sulfonylamino]naphthalene-1-sulfonic acid
CID 88674163
N-phenylnaphthalene-1-sulfonamide
CID 3816137
4-(benzenesulfonamido)-N-phenylbenzenesulfonamide
CID 1333712
1-(hydroxymethyl)-N-phenylnaphthalene-2-sulfonamide
CID 146459884

Frequently Asked Questions

What is the IUPAC name of 7-hydroxy-1-N,3-N-diphenylnaphthalene-1,3-disulfonamide?
The IUPAC name of 7-hydroxy-1-N,3-N-diphenylnaphthalene-1,3-disulfonamide (CID 1376755) is 7-hydroxy-1-N,3-N-diphenylnaphthalene-1,3-disulfonamide.
What is the SMILES notation for 7-hydroxy-1-N,3-N-diphenylnaphthalene-1,3-disulfonamide?
The canonical SMILES for 7-hydroxy-1-N,3-N-diphenylnaphthalene-1,3-disulfonamide is O=S(=O)(Nc1ccccc1)c1cc(S(=O)(=O)Nc2ccccc2)c2cc(O)ccc2c1.
What is the InChIKey of 7-hydroxy-1-N,3-N-diphenylnaphthalene-1,3-disulfonamide?
The InChIKey is AZWLEOHSTMDFSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N2O5S2/c25-19-12-11-16-13-20(30(26,27)23-17-7-3-1-4-8-17)15-22(21(16)14-19)31(28,29)24-18-9-5-2-6-10-18/h1-15,23-25H.
What are the key properties of 7-hydroxy-1-N,3-N-diphenylnaphthalene-1,3-disulfonamide?
7-hydroxy-1-N,3-N-diphenylnaphthalene-1,3-disulfonamide has a molecular weight of 454.53 g/mol, XLogP of 4.15, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxy-1-N,3-N-diphenylnaphthalene-1,3-disulfonamide is sourced from PubChem (CID 1376755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).