N'-[(6-chloro-3-pyridinyl)sulfonyl]-2,2-diphenylacetohydrazide

C19H16ClN3O3S — CID 4729945

IUPACN'-[(6-chloro-3-pyridinyl)sulfonyl]-2,2-diphenylacetohydrazide
SMILESO=C(NNS(=O)(=O)c1ccc(Cl)nc1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H16ClN3O3S/c20-17-12-11-16(13-21-17)27(25,26)23-22-19(24)18(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-13,18,23H,(H,22,24)
InChIKeyQZDSMNJIDAEZOA-UHFFFAOYSA-N
MW401.88 g/mol
LogP2.88
Rot. Bonds6

About N'-[(6-chloro-3-pyridinyl)sulfonyl]-2,2-diphenylacetohydrazide

N'-[(6-chloro-3-pyridinyl)sulfonyl]-2,2-diphenylacetohydrazide (PubChem CID 4729945) has the molecular formula C19H16ClN3O3S and a molecular weight of 401.88 g/mol. Its IUPAC name is N'-[(6-chloro-3-pyridinyl)sulfonyl]-2,2-diphenylacetohydrazide.

Molecular Properties

Compound NameN'-[(6-chloro-3-pyridinyl)sulfonyl]-2,2-diphenylacetohydrazide
PubChem CID4729945
Molecular FormulaC19H16ClN3O3S
Molecular Weight401.88 g/mol
Exact Mass401.06
IUPAC NameN'-[(6-chloro-3-pyridinyl)sulfonyl]-2,2-diphenylacetohydrazide
SMILESO=C(NNS(=O)(=O)c1ccc(Cl)nc1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H16ClN3O3S/c20-17-12-11-16(13-21-17)27(25,26)23-22-19(24)18(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-13,18,23H,(H,22,24)
InChIKeyQZDSMNJIDAEZOA-UHFFFAOYSA-N
XLogP2.88
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.88
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-chloro-N'-phenylpyridine-3-sulfonohydrazide
CID 4729877
N'-[(6-chloro-3-pyridinyl)sulfonyl]-2-fluorobenzohydrazide
CID 4729927
2-bromo-N'-[(6-chloro-3-pyridinyl)sulfonyl]benzohydrazide
CID 4729929
6-chloro-N-phenylpyridine-3-sulfonamide
CID 4729892
N'-[(6-chloro-3-pyridinyl)sulfonyl]-4-fluorobenzohydrazide
CID 4729924
6-chloro-N-[2-(dimethylamino)-2-phenylethyl]pyridine-3-sulfonamide
CID 110301918
2,4-dichloro-N'-[(6-chloro-3-pyridinyl)sulfonyl]benzohydrazide
CID 4729935
N-(2-acetylphenyl)-6-chloropyridine-3-sulfonamide
CID 2683694
N'-[(6-chloro-3-pyridinyl)sulfonyl]-4-nitrobenzohydrazide
CID 4729926
3-[(6-chloro-3-pyridinyl)sulfonylamino]benzoic acid
CID 7938689
6-chloro-N-[(2S)-4-phenylbutan-2-yl]pyridine-3-sulfonamide
CID 7510271
N'-[(6-chloro-3-pyridinyl)sulfonyl]-4-(diethylamino)benzohydrazide
CID 2683676

Frequently Asked Questions

What is the IUPAC name of N'-[(6-chloro-3-pyridinyl)sulfonyl]-2,2-diphenylacetohydrazide?
The IUPAC name of N'-[(6-chloro-3-pyridinyl)sulfonyl]-2,2-diphenylacetohydrazide (CID 4729945) is N'-[(6-chloro-3-pyridinyl)sulfonyl]-2,2-diphenylacetohydrazide.
What is the SMILES notation for N'-[(6-chloro-3-pyridinyl)sulfonyl]-2,2-diphenylacetohydrazide?
The canonical SMILES for N'-[(6-chloro-3-pyridinyl)sulfonyl]-2,2-diphenylacetohydrazide is O=C(NNS(=O)(=O)c1ccc(Cl)nc1)C(c1ccccc1)c1ccccc1.
What is the InChIKey of N'-[(6-chloro-3-pyridinyl)sulfonyl]-2,2-diphenylacetohydrazide?
The InChIKey is QZDSMNJIDAEZOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClN3O3S/c20-17-12-11-16(13-21-17)27(25,26)23-22-19(24)18(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-13,18,23H,(H,22,24).
What are the key properties of N'-[(6-chloro-3-pyridinyl)sulfonyl]-2,2-diphenylacetohydrazide?
N'-[(6-chloro-3-pyridinyl)sulfonyl]-2,2-diphenylacetohydrazide has a molecular weight of 401.88 g/mol, XLogP of 2.88, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(6-chloro-3-pyridinyl)sulfonyl]-2,2-diphenylacetohydrazide is sourced from PubChem (CID 4729945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).