2-chloro-5-nitro-N',N'-diphenylbenzohydrazide

C19H14ClN3O3 — CID 14956446

IUPAC2-chloro-5-nitro-N',N'-diphenylbenzohydrazide
SMILESO=C(NN(c1ccccc1)c1ccccc1)c1cc([N+](=O)[O-])ccc1Cl
InChIInChI=1S/C19H14ClN3O3/c20-18-12-11-16(23(25)26)13-17(18)19(24)21-22(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-13H,(H,21,24)
InChIKeyBHFRRLWDWMVEBH-UHFFFAOYSA-N
MW367.79 g/mol
LogP4.73
Rot. Bonds5

About 2-chloro-5-nitro-N',N'-diphenylbenzohydrazide

2-chloro-5-nitro-N',N'-diphenylbenzohydrazide (PubChem CID 14956446) has the molecular formula C19H14ClN3O3 and a molecular weight of 367.79 g/mol. Its IUPAC name is 2-chloro-5-nitro-N',N'-diphenylbenzohydrazide.

Molecular Properties

Compound Name2-chloro-5-nitro-N',N'-diphenylbenzohydrazide
PubChem CID14956446
Molecular FormulaC19H14ClN3O3
Molecular Weight367.79 g/mol
Exact Mass367.07
IUPAC Name2-chloro-5-nitro-N',N'-diphenylbenzohydrazide
SMILESO=C(NN(c1ccccc1)c1ccccc1)c1cc([N+](=O)[O-])ccc1Cl
InChIInChI=1S/C19H14ClN3O3/c20-18-12-11-16(23(25)26)13-17(18)19(24)21-22(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-13H,(H,21,24)
InChIKeyBHFRRLWDWMVEBH-UHFFFAOYSA-N
XLogP4.73
TPSA75.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.79
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-nitro-N',N'-diphenylbenzohydrazide?
The IUPAC name of 2-chloro-5-nitro-N',N'-diphenylbenzohydrazide (CID 14956446) is 2-chloro-5-nitro-N',N'-diphenylbenzohydrazide.
What is the SMILES notation for 2-chloro-5-nitro-N',N'-diphenylbenzohydrazide?
The canonical SMILES for 2-chloro-5-nitro-N',N'-diphenylbenzohydrazide is O=C(NN(c1ccccc1)c1ccccc1)c1cc([N+](=O)[O-])ccc1Cl.
What is the InChIKey of 2-chloro-5-nitro-N',N'-diphenylbenzohydrazide?
The InChIKey is BHFRRLWDWMVEBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14ClN3O3/c20-18-12-11-16(23(25)26)13-17(18)19(24)21-22(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-13H,(H,21,24).
What are the key properties of 2-chloro-5-nitro-N',N'-diphenylbenzohydrazide?
2-chloro-5-nitro-N',N'-diphenylbenzohydrazide has a molecular weight of 367.79 g/mol, XLogP of 4.73, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-nitro-N',N'-diphenylbenzohydrazide is sourced from PubChem (CID 14956446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).