2-chloro-4-hydroxy-N'-[2-(3-hydroxyphenyl)acetyl]-6-methoxybenzohydrazide

C16H15ClN2O5 — CID 59421967

IUPAC2-chloro-4-hydroxy-N'-[2-(3-hydroxyphenyl)acetyl]-6-methoxybenzohydrazide
SMILESCOc1cc(O)cc(Cl)c1C(=O)NNC(=O)Cc1cccc(O)c1
InChIInChI=1S/C16H15ClN2O5/c1-24-13-8-11(21)7-12(17)15(13)16(23)19-18-14(22)6-9-3-2-4-10(20)5-9/h2-5,7-8,20-21H,6H2,1H3,(H,18,22)(H,19,23)
InChIKeySSORXXSSEXCWIQ-UHFFFAOYSA-N
MW350.76 g/mol
LogP1.76
Rot. Bonds4

About 2-chloro-4-hydroxy-N'-[2-(3-hydroxyphenyl)acetyl]-6-methoxybenzohydrazide

2-chloro-4-hydroxy-N'-[2-(3-hydroxyphenyl)acetyl]-6-methoxybenzohydrazide (PubChem CID 59421967) has the molecular formula C16H15ClN2O5 and a molecular weight of 350.76 g/mol. Its IUPAC name is 2-chloro-4-hydroxy-N'-[2-(3-hydroxyphenyl)acetyl]-6-methoxybenzohydrazide.

Molecular Properties

Compound Name2-chloro-4-hydroxy-N'-[2-(3-hydroxyphenyl)acetyl]-6-methoxybenzohydrazide
PubChem CID59421967
Molecular FormulaC16H15ClN2O5
Molecular Weight350.76 g/mol
Exact Mass350.07
IUPAC Name2-chloro-4-hydroxy-N'-[2-(3-hydroxyphenyl)acetyl]-6-methoxybenzohydrazide
SMILESCOc1cc(O)cc(Cl)c1C(=O)NNC(=O)Cc1cccc(O)c1
InChIInChI=1S/C16H15ClN2O5/c1-24-13-8-11(21)7-12(17)15(13)16(23)19-18-14(22)6-9-3-2-4-10(20)5-9/h2-5,7-8,20-21H,6H2,1H3,(H,18,22)(H,19,23)
InChIKeySSORXXSSEXCWIQ-UHFFFAOYSA-N
XLogP1.76
TPSA107.89 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.76
LogP ≤ 51.76
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-chloro-N'-[2-(3-hydroxyphenyl)acetyl]-4,5-dimethoxybenzohydrazide
CID 59421984
methyl 4-[[[2-(3-hydroxyphenyl)acetyl]amino]carbamoyl]benzoate
CID 59421998
N'-[2-(2,6-dichlorophenyl)acetyl]-3,4-dimethoxybenzohydrazide
CID 35934045
4-(chloromethyl)-N'-[2-(3-hydroxyphenyl)acetyl]benzohydrazide
CID 59422014
N-[(3-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide
CID 47292082
N-(2,5-dimethoxyphenyl)-2-(3-hydroxyphenyl)acetamide
CID 61399992
2,3-dimethoxy-N'-(2-phenylacetyl)benzohydrazide
CID 912695
2-chloro-4,6-dihydroxy-N-[2-(3-hydroxyphenyl)acetyl]benzohydrazide
CID 90965237
2-fluoro-N'-[2-(3-hydroxyphenyl)acetyl]benzohydrazide
CID 59422019
N'-[2-(3-hydroxyphenyl)acetyl]-3-iodobenzohydrazide
CID 149266850
1-benzyl-3-[[2-(3-chloro-4-methoxyphenyl)acetyl]amino]thiourea
CID 34948341
N'-[2-(3,4-dimethoxyphenyl)acetyl]-2-hydroxybenzohydrazide
CID 7535074

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-hydroxy-N'-[2-(3-hydroxyphenyl)acetyl]-6-methoxybenzohydrazide?
The IUPAC name of 2-chloro-4-hydroxy-N'-[2-(3-hydroxyphenyl)acetyl]-6-methoxybenzohydrazide (CID 59421967) is 2-chloro-4-hydroxy-N'-[2-(3-hydroxyphenyl)acetyl]-6-methoxybenzohydrazide.
What is the SMILES notation for 2-chloro-4-hydroxy-N'-[2-(3-hydroxyphenyl)acetyl]-6-methoxybenzohydrazide?
The canonical SMILES for 2-chloro-4-hydroxy-N'-[2-(3-hydroxyphenyl)acetyl]-6-methoxybenzohydrazide is COc1cc(O)cc(Cl)c1C(=O)NNC(=O)Cc1cccc(O)c1.
What is the InChIKey of 2-chloro-4-hydroxy-N'-[2-(3-hydroxyphenyl)acetyl]-6-methoxybenzohydrazide?
The InChIKey is SSORXXSSEXCWIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClN2O5/c1-24-13-8-11(21)7-12(17)15(13)16(23)19-18-14(22)6-9-3-2-4-10(20)5-9/h2-5,7-8,20-21H,6H2,1H3,(H,18,22)(H,19,23).
What are the key properties of 2-chloro-4-hydroxy-N'-[2-(3-hydroxyphenyl)acetyl]-6-methoxybenzohydrazide?
2-chloro-4-hydroxy-N'-[2-(3-hydroxyphenyl)acetyl]-6-methoxybenzohydrazide has a molecular weight of 350.76 g/mol, XLogP of 1.76, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-hydroxy-N'-[2-(3-hydroxyphenyl)acetyl]-6-methoxybenzohydrazide is sourced from PubChem (CID 59421967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).