2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N'-(2-hydroxybenzoyl)benzohydrazide

C23H16FN3O4 — CID 36762830

IUPAC2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N'-(2-hydroxybenzoyl)benzohydrazide
SMILESO=C(NNC(=O)c1ccccc1-c1ncc(-c2ccccc2F)o1)c1ccccc1O
InChIInChI=1S/C23H16FN3O4/c24-18-11-5-3-9-16(18)20-13-25-23(31-20)15-8-2-1-7-14(15)21(29)26-27-22(30)17-10-4-6-12-19(17)28/h1-13,28H,(H,26,29)(H,27,30)
InChIKeyOSFVMVFATKTJKU-UHFFFAOYSA-N
MW417.40 g/mol
LogP3.93
Rot. Bonds4

About 2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N'-(2-hydroxybenzoyl)benzohydrazide

2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N'-(2-hydroxybenzoyl)benzohydrazide (PubChem CID 36762830) has the molecular formula C23H16FN3O4 and a molecular weight of 417.40 g/mol. Its IUPAC name is 2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N'-(2-hydroxybenzoyl)benzohydrazide.

Molecular Properties

Compound Name2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N'-(2-hydroxybenzoyl)benzohydrazide
PubChem CID36762830
Molecular FormulaC23H16FN3O4
Molecular Weight417.40 g/mol
Exact Mass417.11
IUPAC Name2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N'-(2-hydroxybenzoyl)benzohydrazide
SMILESO=C(NNC(=O)c1ccccc1-c1ncc(-c2ccccc2F)o1)c1ccccc1O
InChIInChI=1S/C23H16FN3O4/c24-18-11-5-3-9-16(18)20-13-25-23(31-20)15-8-2-1-7-14(15)21(29)26-27-22(30)17-10-4-6-12-19(17)28/h1-13,28H,(H,26,29)(H,27,30)
InChIKeyOSFVMVFATKTJKU-UHFFFAOYSA-N
XLogP3.93
TPSA104.46 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500417.40
LogP ≤ 53.93
H-Bond Donors ≤ 53
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-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-(2-methoxyethyl)benzamide
CID 36656774
2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methylbutyl)benzamide
CID 36744321
N-butan-2-yl-2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]benzamide
CID 42945534
N-[2-(4-fluorophenyl)ethyl]-2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]benzamide
CID 36704068
N-(2-fluoro-4-methylphenyl)-2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]benzamide
CID 55554036
methyl 4-[[2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]benzoyl]amino]butanoate
CID 36654951
N-(3-butoxypropyl)-2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]benzamide
CID 36807682
2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)benzamide
CID 154833789
2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-[4-[2-oxo-2-(propan-2-ylamino)ethyl]phenyl]benzamide
CID 39683287
2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-(piperidin-3-ylmethyl)benzamide
CID 119461006
2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-(2-methyl-3-nitrophenyl)benzamide
CID 52730959
N'-[2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]benzoyl]-2-methylfuran-3-carbohydrazide
CID 36702942

Frequently Asked Questions

What is the IUPAC name of 2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N'-(2-hydroxybenzoyl)benzohydrazide?
The IUPAC name of 2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N'-(2-hydroxybenzoyl)benzohydrazide (CID 36762830) is 2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N'-(2-hydroxybenzoyl)benzohydrazide.
What is the SMILES notation for 2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N'-(2-hydroxybenzoyl)benzohydrazide?
The canonical SMILES for 2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N'-(2-hydroxybenzoyl)benzohydrazide is O=C(NNC(=O)c1ccccc1-c1ncc(-c2ccccc2F)o1)c1ccccc1O.
What is the InChIKey of 2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N'-(2-hydroxybenzoyl)benzohydrazide?
The InChIKey is OSFVMVFATKTJKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16FN3O4/c24-18-11-5-3-9-16(18)20-13-25-23(31-20)15-8-2-1-7-14(15)21(29)26-27-22(30)17-10-4-6-12-19(17)28/h1-13,28H,(H,26,29)(H,27,30).
What are the key properties of 2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N'-(2-hydroxybenzoyl)benzohydrazide?
2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N'-(2-hydroxybenzoyl)benzohydrazide has a molecular weight of 417.40 g/mol, XLogP of 3.93, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N'-(2-hydroxybenzoyl)benzohydrazide is sourced from PubChem (CID 36762830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).