N-[4-[(2-hydrazinyl-2-oxoacetyl)sulfamoyl]phenyl]benzamide

C15H14N4O5S — CID 21204126

IUPACN-[4-[(2-hydrazinyl-2-oxoacetyl)sulfamoyl]phenyl]benzamide
SMILESNNC(=O)C(=O)NS(=O)(=O)c1ccc(NC(=O)c2ccccc2)cc1
InChIInChI=1S/C15H14N4O5S/c16-18-14(21)15(22)19-25(23,24)12-8-6-11(7-9-12)17-13(20)10-4-2-1-3-5-10/h1-9H,16H2,(H,17,20)(H,18,21)(H,19,22)
InChIKeyZEOAQAMIKSVHHF-UHFFFAOYSA-N
MW362.37 g/mol
LogP-0.27
Rot. Bonds4

About N-[4-[(2-hydrazinyl-2-oxoacetyl)sulfamoyl]phenyl]benzamide

N-[4-[(2-hydrazinyl-2-oxoacetyl)sulfamoyl]phenyl]benzamide (PubChem CID 21204126) has the molecular formula C15H14N4O5S and a molecular weight of 362.37 g/mol. Its IUPAC name is N-[4-[(2-hydrazinyl-2-oxoacetyl)sulfamoyl]phenyl]benzamide.

Molecular Properties

Compound NameN-[4-[(2-hydrazinyl-2-oxoacetyl)sulfamoyl]phenyl]benzamide
PubChem CID21204126
Molecular FormulaC15H14N4O5S
Molecular Weight362.37 g/mol
Exact Mass362.07
IUPAC NameN-[4-[(2-hydrazinyl-2-oxoacetyl)sulfamoyl]phenyl]benzamide
SMILESNNC(=O)C(=O)NS(=O)(=O)c1ccc(NC(=O)c2ccccc2)cc1
InChIInChI=1S/C15H14N4O5S/c16-18-14(21)15(22)19-25(23,24)12-8-6-11(7-9-12)17-13(20)10-4-2-1-3-5-10/h1-9H,16H2,(H,17,20)(H,18,21)(H,19,22)
InChIKeyZEOAQAMIKSVHHF-UHFFFAOYSA-N
XLogP-0.27
TPSA147.46 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.37
LogP ≤ 5-0.27
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[4-(acetylsulfamoyl)phenyl]-4-benzamidobenzamide
CID 17153285
methyl 4-benzamidobenzenesulfonate
CID 141379747
N-[4-[[3-[(4-benzamidophenyl)sulfonylcarbamoylamino]-4-methylphenyl]carbamoylsulfamoyl]phenyl]benzamide
CID 139878369
1-N,4-N-bis[4-(benzylsulfamoyl)phenyl]benzene-1,4-dicarboxamide
CID 4929117
N-[4-(carbamoylsulfamoyl)phenyl]-3-methylbenzamide
CID 38112845
N-[4-(dimethylcarbamoylamino)phenyl]sulfonylbenzamide;ethane;methane
CID 160542881
N-[4-[[(4-methylphenyl)sulfonylamino]carbamoyl]phenyl]benzamide
CID 3293465
(4-benzamidophenyl)carbamic acid
CID 18543096
4-(ethylsulfamoyl)-N-phenylbenzamide
CID 1262046
3-(4-benzamidophenyl)sulfonylpropanoic acid
CID 18368976
N-[4-(4-phenylphenyl)phenyl]benzamide
CID 59742294
N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]benzamide
CID 2324236

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2-hydrazinyl-2-oxoacetyl)sulfamoyl]phenyl]benzamide?
The IUPAC name of N-[4-[(2-hydrazinyl-2-oxoacetyl)sulfamoyl]phenyl]benzamide (CID 21204126) is N-[4-[(2-hydrazinyl-2-oxoacetyl)sulfamoyl]phenyl]benzamide.
What is the SMILES notation for N-[4-[(2-hydrazinyl-2-oxoacetyl)sulfamoyl]phenyl]benzamide?
The canonical SMILES for N-[4-[(2-hydrazinyl-2-oxoacetyl)sulfamoyl]phenyl]benzamide is NNC(=O)C(=O)NS(=O)(=O)c1ccc(NC(=O)c2ccccc2)cc1.
What is the InChIKey of N-[4-[(2-hydrazinyl-2-oxoacetyl)sulfamoyl]phenyl]benzamide?
The InChIKey is ZEOAQAMIKSVHHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O5S/c16-18-14(21)15(22)19-25(23,24)12-8-6-11(7-9-12)17-13(20)10-4-2-1-3-5-10/h1-9H,16H2,(H,17,20)(H,18,21)(H,19,22).
What are the key properties of N-[4-[(2-hydrazinyl-2-oxoacetyl)sulfamoyl]phenyl]benzamide?
N-[4-[(2-hydrazinyl-2-oxoacetyl)sulfamoyl]phenyl]benzamide has a molecular weight of 362.37 g/mol, XLogP of -0.27, 4 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2-hydrazinyl-2-oxoacetyl)sulfamoyl]phenyl]benzamide is sourced from PubChem (CID 21204126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).