N-[4-(benzenesulfonamido)-1-hydroxynaphthalen-2-yl]imino-3,5-dihydroxybenzamide

C23H17N3O6S — CID 135777327

IUPACN-[4-(benzenesulfonamido)-1-hydroxynaphthalen-2-yl]imino-3,5-dihydroxybenzamide
SMILESO=C(/N=N/c1cc(NS(=O)(=O)c2ccccc2)c2ccccc2c1O)c1cc(O)cc(O)c1
InChIInChI=1S/C23H17N3O6S/c27-15-10-14(11-16(28)12-15)23(30)25-24-21-13-20(18-8-4-5-9-19(18)22(21)29)26-33(31,32)17-6-2-1-3-7-17/h1-13,26-29H/b25-24+
InChIKeyVEZBNKFIOIAQKZ-OCOZRVBESA-N
MW463.47 g/mol
LogP4.68
Rot. Bonds5

About N-[4-(benzenesulfonamido)-1-hydroxynaphthalen-2-yl]imino-3,5-dihydroxybenzamide

N-[4-(benzenesulfonamido)-1-hydroxynaphthalen-2-yl]imino-3,5-dihydroxybenzamide (PubChem CID 135777327) has the molecular formula C23H17N3O6S and a molecular weight of 463.47 g/mol. Its IUPAC name is N-[4-(benzenesulfonamido)-1-hydroxynaphthalen-2-yl]imino-3,5-dihydroxybenzamide.

Molecular Properties

Compound NameN-[4-(benzenesulfonamido)-1-hydroxynaphthalen-2-yl]imino-3,5-dihydroxybenzamide
PubChem CID135777327
Molecular FormulaC23H17N3O6S
Molecular Weight463.47 g/mol
Exact Mass463.08
IUPAC NameN-[4-(benzenesulfonamido)-1-hydroxynaphthalen-2-yl]imino-3,5-dihydroxybenzamide
SMILESO=C(/N=N/c1cc(NS(=O)(=O)c2ccccc2)c2ccccc2c1O)c1cc(O)cc(O)c1
InChIInChI=1S/C23H17N3O6S/c27-15-10-14(11-16(28)12-15)23(30)25-24-21-13-20(18-8-4-5-9-19(18)22(21)29)26-33(31,32)17-6-2-1-3-7-17/h1-13,26-29H/b25-24+
InChIKeyVEZBNKFIOIAQKZ-OCOZRVBESA-N
XLogP4.68
TPSA148.65 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500463.47
LogP ≤ 54.68
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'sulfonamide_B(41)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'hydroquinone', 'substructure': 'N/A'}

Analyze N-[4-(benzenesulfonamido)-1-hydroxynaphthalen-2-yl]imino-3,5-dihydroxybenzamide 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-(benzenesulfonamido)-1-hydroxynaphthalen-2-yl]imino-3-chlorobenzamide
CID 5089017
N-[4-(benzenesulfonamido)-1-hydroxynaphthalen-2-yl]iminofuran-2-carboxamide
CID 5089354
N-[1-hydroxy-4-[(4-methoxyphenyl)sulfonylamino]naphthalen-2-yl]imino-4-methoxybenzamide
CID 3487122
N-[4-[(4-bromophenyl)sulfonylamino]-1-hydroxynaphthalen-2-yl]iminonaphthalene-2-carboxamide
CID 3498825
N-[4-(benzenesulfonamido)-1-hydroxynaphthalen-2-yl]imino-2-methoxybenzamide
CID 5089172
3-amino-N-[1-hydroxy-4-[(4-methylphenyl)sulfonylamino]naphthalen-2-yl]iminobenzamide
CID 3463382
N-[4-[(4-chlorophenyl)sulfonylamino]-1-hydroxynaphthalen-2-yl]imino-2,4-dihydroxybenzamide
CID 3478501
N-[[4-(benzenesulfonamido)-1-hydroxy-5,8-dihydronaphthalen-2-yl]imino]-3-hydroxybenzamide
CID 135669369
3,5-dihydroxy-N-[[1-hydroxy-4-[(4-methylphenyl)sulfonylamino]-5,8-dihydronaphthalen-2-yl]imino]benzamide
CID 135669410
N-[4-[(4-chlorophenyl)sulfonylamino]-1-hydroxynaphthalen-2-yl]imino-2,4-dinitrobenzamide
CID 3473999
N-[5-(benzenesulfonamido)naphthalen-1-yl]benzenesulfonamide
CID 3389796
N-[[1-hydroxy-4-(methanesulfonamido)-5,8-dihydronaphthalen-2-yl]imino]benzamide
CID 135669412

Frequently Asked Questions

What is the IUPAC name of N-[4-(benzenesulfonamido)-1-hydroxynaphthalen-2-yl]imino-3,5-dihydroxybenzamide?
The IUPAC name of N-[4-(benzenesulfonamido)-1-hydroxynaphthalen-2-yl]imino-3,5-dihydroxybenzamide (CID 135777327) is N-[4-(benzenesulfonamido)-1-hydroxynaphthalen-2-yl]imino-3,5-dihydroxybenzamide.
What is the SMILES notation for N-[4-(benzenesulfonamido)-1-hydroxynaphthalen-2-yl]imino-3,5-dihydroxybenzamide?
The canonical SMILES for N-[4-(benzenesulfonamido)-1-hydroxynaphthalen-2-yl]imino-3,5-dihydroxybenzamide is O=C(/N=N/c1cc(NS(=O)(=O)c2ccccc2)c2ccccc2c1O)c1cc(O)cc(O)c1.
What is the InChIKey of N-[4-(benzenesulfonamido)-1-hydroxynaphthalen-2-yl]imino-3,5-dihydroxybenzamide?
The InChIKey is VEZBNKFIOIAQKZ-OCOZRVBESA-N. The full InChI is InChI=1S/C23H17N3O6S/c27-15-10-14(11-16(28)12-15)23(30)25-24-21-13-20(18-8-4-5-9-19(18)22(21)29)26-33(31,32)17-6-2-1-3-7-17/h1-13,26-29H/b25-24+.
What are the key properties of N-[4-(benzenesulfonamido)-1-hydroxynaphthalen-2-yl]imino-3,5-dihydroxybenzamide?
N-[4-(benzenesulfonamido)-1-hydroxynaphthalen-2-yl]imino-3,5-dihydroxybenzamide has a molecular weight of 463.47 g/mol, XLogP of 4.68, 5 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(benzenesulfonamido)-1-hydroxynaphthalen-2-yl]imino-3,5-dihydroxybenzamide is sourced from PubChem (CID 135777327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).