N'-[2-(4-chlorophenyl)sulfanylacetyl]-2-hydroxybenzohydrazide

C15H13ClN2O3S — CID 35515360

IUPACN'-[2-(4-chlorophenyl)sulfanylacetyl]-2-hydroxybenzohydrazide
SMILESO=C(CSc1ccc(Cl)cc1)NNC(=O)c1ccccc1O
InChIInChI=1S/C15H13ClN2O3S/c16-10-5-7-11(8-6-10)22-9-14(20)17-18-15(21)12-3-1-2-4-13(12)19/h1-8,19H,9H2,(H,17,20)(H,18,21)
InChIKeySIDLZAQHXWGMEB-UHFFFAOYSA-N
MW336.80 g/mol
LogP2.60
Rot. Bonds4

About N'-[2-(4-chlorophenyl)sulfanylacetyl]-2-hydroxybenzohydrazide

N'-[2-(4-chlorophenyl)sulfanylacetyl]-2-hydroxybenzohydrazide (PubChem CID 35515360) has the molecular formula C15H13ClN2O3S and a molecular weight of 336.80 g/mol. Its IUPAC name is N'-[2-(4-chlorophenyl)sulfanylacetyl]-2-hydroxybenzohydrazide.

Molecular Properties

Compound NameN'-[2-(4-chlorophenyl)sulfanylacetyl]-2-hydroxybenzohydrazide
PubChem CID35515360
Molecular FormulaC15H13ClN2O3S
Molecular Weight336.80 g/mol
Exact Mass336.03
IUPAC NameN'-[2-(4-chlorophenyl)sulfanylacetyl]-2-hydroxybenzohydrazide
SMILESO=C(CSc1ccc(Cl)cc1)NNC(=O)c1ccccc1O
InChIInChI=1S/C15H13ClN2O3S/c16-10-5-7-11(8-6-10)22-9-14(20)17-18-15(21)12-3-1-2-4-13(12)19/h1-8,19H,9H2,(H,17,20)(H,18,21)
InChIKeySIDLZAQHXWGMEB-UHFFFAOYSA-N
XLogP2.60
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.80
LogP ≤ 52.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-[2-(4-chlorophenyl)sulfanylacetyl]-2-propan-2-ylsulfanylbenzohydrazide
CID 78778091
N'-[2-(4-tert-butylphenyl)sulfanylacetyl]-2-chlorobenzohydrazide
CID 35930229
2-chloro-N'-[2-(4-nitrophenyl)sulfanylacetyl]benzohydrazide
CID 35929032
N'-[2-(4-chlorophenyl)sulfanylacetyl]-1-methyl-2-oxoquinoline-4-carbohydrazide
CID 55787862
1-N',3-N'-bis(2-hydroxybenzoyl)propanedihydrazide
CID 21348404
N'-[2-(4-chlorophenyl)sulfanylpropanoyl]-2-hydroxybenzohydrazide
CID 18109178
4-chloro-N'-[2-(4-methoxyphenyl)sulfanylacetyl]benzohydrazide
CID 26649394
2-chloro-N-[1-[2-[2-(4-methylphenyl)sulfanylacetyl]hydrazinyl]-1-oxopropan-2-yl]benzamide
CID 18285174
2-chloro-N'-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetyl]benzohydrazide
CID 4805905
4-chloro-N'-[2-(4-nitrophenyl)sulfanylacetyl]benzohydrazide
CID 4832063
2-hydroxy-N'-propanoylbenzohydrazide
CID 15893878
5-chloro-2-fluoro-N'-[2-(2-fluorophenyl)sulfanylacetyl]benzohydrazide
CID 9091331

Frequently Asked Questions

What is the IUPAC name of N'-[2-(4-chlorophenyl)sulfanylacetyl]-2-hydroxybenzohydrazide?
The IUPAC name of N'-[2-(4-chlorophenyl)sulfanylacetyl]-2-hydroxybenzohydrazide (CID 35515360) is N'-[2-(4-chlorophenyl)sulfanylacetyl]-2-hydroxybenzohydrazide.
What is the SMILES notation for N'-[2-(4-chlorophenyl)sulfanylacetyl]-2-hydroxybenzohydrazide?
The canonical SMILES for N'-[2-(4-chlorophenyl)sulfanylacetyl]-2-hydroxybenzohydrazide is O=C(CSc1ccc(Cl)cc1)NNC(=O)c1ccccc1O.
What is the InChIKey of N'-[2-(4-chlorophenyl)sulfanylacetyl]-2-hydroxybenzohydrazide?
The InChIKey is SIDLZAQHXWGMEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClN2O3S/c16-10-5-7-11(8-6-10)22-9-14(20)17-18-15(21)12-3-1-2-4-13(12)19/h1-8,19H,9H2,(H,17,20)(H,18,21).
What are the key properties of N'-[2-(4-chlorophenyl)sulfanylacetyl]-2-hydroxybenzohydrazide?
N'-[2-(4-chlorophenyl)sulfanylacetyl]-2-hydroxybenzohydrazide has a molecular weight of 336.80 g/mol, XLogP of 2.60, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(4-chlorophenyl)sulfanylacetyl]-2-hydroxybenzohydrazide is sourced from PubChem (CID 35515360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).