N'-[(6-chloro-3-pyridinyl)sulfonyl]-4-(diethylamino)benzohydrazide

C16H19ClN4O3S — CID 2683676

IUPACN'-[(6-chloro-3-pyridinyl)sulfonyl]-4-(diethylamino)benzohydrazide
SMILESCCN(CC)c1ccc(C(=O)NNS(=O)(=O)c2ccc(Cl)nc2)cc1
InChIInChI=1S/C16H19ClN4O3S/c1-3-21(4-2)13-7-5-12(6-8-13)16(22)19-20-25(23,24)14-9-10-15(17)18-11-14/h5-11,20H,3-4H2,1-2H3,(H,19,22)
InChIKeyNUKBOLRGLFECJI-UHFFFAOYSA-N
MW382.87 g/mol
LogP2.20
Rot. Bonds7

About N'-[(6-chloro-3-pyridinyl)sulfonyl]-4-(diethylamino)benzohydrazide

N'-[(6-chloro-3-pyridinyl)sulfonyl]-4-(diethylamino)benzohydrazide (PubChem CID 2683676) has the molecular formula C16H19ClN4O3S and a molecular weight of 382.87 g/mol. Its IUPAC name is N'-[(6-chloro-3-pyridinyl)sulfonyl]-4-(diethylamino)benzohydrazide.

Molecular Properties

Compound NameN'-[(6-chloro-3-pyridinyl)sulfonyl]-4-(diethylamino)benzohydrazide
PubChem CID2683676
Molecular FormulaC16H19ClN4O3S
Molecular Weight382.87 g/mol
Exact Mass382.09
IUPAC NameN'-[(6-chloro-3-pyridinyl)sulfonyl]-4-(diethylamino)benzohydrazide
SMILESCCN(CC)c1ccc(C(=O)NNS(=O)(=O)c2ccc(Cl)nc2)cc1
InChIInChI=1S/C16H19ClN4O3S/c1-3-21(4-2)13-7-5-12(6-8-13)16(22)19-20-25(23,24)14-9-10-15(17)18-11-14/h5-11,20H,3-4H2,1-2H3,(H,19,22)
InChIKeyNUKBOLRGLFECJI-UHFFFAOYSA-N
XLogP2.20
TPSA91.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.87
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N'-[(6-chloro-3-pyridinyl)sulfonyl]-4-(diethylamino)benzohydrazide 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'-[(6-chloro-3-pyridinyl)sulfonyl]-4-fluorobenzohydrazide
CID 4729924
N'-[(6-chloro-3-pyridinyl)sulfonyl]-4-nitrobenzohydrazide
CID 4729926
N'-(3-chloro-2,4,6-trifluorophenyl)sulfonyl-4-(diethylamino)benzohydrazide
CID 2563050
4-(diethylamino)-N'-[(2-oxo-1,3-dihydroindol-5-yl)sulfonyl]benzohydrazide
CID 9030537
4-[(6-chloro-3-pyridinyl)sulfonylamino]-N,N-diethylbenzamide
CID 2683843
2,4-dichloro-N'-[(6-chloro-3-pyridinyl)sulfonyl]benzohydrazide
CID 4729935
N'-[(6-chloro-3-pyridinyl)sulfonyl]-2-fluorobenzohydrazide
CID 4729927
2-bromo-N'-[(6-chloro-3-pyridinyl)sulfonyl]benzohydrazide
CID 4729929
N'-[4-(diethylamino)benzoyl]-6-methylpyridine-3-carbohydrazide
CID 30288485
N-[4-(diethylamino)phenyl]-4-(methylsulfamoyl)benzamide
CID 27229396
N'-[4-(diethylamino)benzoyl]-4-(methylsulfonylmethyl)benzohydrazide
CID 9155961
N'-(4-chlorophenyl)sulfonyl-4-methylbenzohydrazide
CID 932051

Frequently Asked Questions

What is the IUPAC name of N'-[(6-chloro-3-pyridinyl)sulfonyl]-4-(diethylamino)benzohydrazide?
The IUPAC name of N'-[(6-chloro-3-pyridinyl)sulfonyl]-4-(diethylamino)benzohydrazide (CID 2683676) is N'-[(6-chloro-3-pyridinyl)sulfonyl]-4-(diethylamino)benzohydrazide.
What is the SMILES notation for N'-[(6-chloro-3-pyridinyl)sulfonyl]-4-(diethylamino)benzohydrazide?
The canonical SMILES for N'-[(6-chloro-3-pyridinyl)sulfonyl]-4-(diethylamino)benzohydrazide is CCN(CC)c1ccc(C(=O)NNS(=O)(=O)c2ccc(Cl)nc2)cc1.
What is the InChIKey of N'-[(6-chloro-3-pyridinyl)sulfonyl]-4-(diethylamino)benzohydrazide?
The InChIKey is NUKBOLRGLFECJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19ClN4O3S/c1-3-21(4-2)13-7-5-12(6-8-13)16(22)19-20-25(23,24)14-9-10-15(17)18-11-14/h5-11,20H,3-4H2,1-2H3,(H,19,22).
What are the key properties of N'-[(6-chloro-3-pyridinyl)sulfonyl]-4-(diethylamino)benzohydrazide?
N'-[(6-chloro-3-pyridinyl)sulfonyl]-4-(diethylamino)benzohydrazide has a molecular weight of 382.87 g/mol, XLogP of 2.20, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(6-chloro-3-pyridinyl)sulfonyl]-4-(diethylamino)benzohydrazide is sourced from PubChem (CID 2683676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).