N'-tert-butyl-2-chloro-N'-(2-chlorobenzoyl)benzohydrazide

C18H18Cl2N2O2 — CID 15617803

IUPACN'-tert-butyl-2-chloro-N'-(2-chlorobenzoyl)benzohydrazide
SMILESCC(C)(C)N(NC(=O)c1ccccc1Cl)C(=O)c1ccccc1Cl
InChIInChI=1S/C18H18Cl2N2O2/c1-18(2,3)22(17(24)13-9-5-7-11-15(13)20)21-16(23)12-8-4-6-10-14(12)19/h4-11H,1-3H3,(H,21,23)
InChIKeyXYKDBVSVTYPSCQ-UHFFFAOYSA-N
MW365.26 g/mol
LogP4.58
Rot. Bonds2

About N'-tert-butyl-2-chloro-N'-(2-chlorobenzoyl)benzohydrazide

N'-tert-butyl-2-chloro-N'-(2-chlorobenzoyl)benzohydrazide (PubChem CID 15617803) has the molecular formula C18H18Cl2N2O2 and a molecular weight of 365.26 g/mol. Its IUPAC name is N'-tert-butyl-2-chloro-N'-(2-chlorobenzoyl)benzohydrazide.

Molecular Properties

Compound NameN'-tert-butyl-2-chloro-N'-(2-chlorobenzoyl)benzohydrazide
PubChem CID15617803
Molecular FormulaC18H18Cl2N2O2
Molecular Weight365.26 g/mol
Exact Mass364.07
IUPAC NameN'-tert-butyl-2-chloro-N'-(2-chlorobenzoyl)benzohydrazide
SMILESCC(C)(C)N(NC(=O)c1ccccc1Cl)C(=O)c1ccccc1Cl
InChIInChI=1S/C18H18Cl2N2O2/c1-18(2,3)22(17(24)13-9-5-7-11-15(13)20)21-16(23)12-8-4-6-10-14(12)19/h4-11H,1-3H3,(H,21,23)
InChIKeyXYKDBVSVTYPSCQ-UHFFFAOYSA-N
XLogP4.58
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.26
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Halofenozide
CID 114994
2-Chloro-n'-(2-chlorobenzoyl)benzohydrazide
CID 258818
1,2-Dibenzoyl-1-(tert-butyl)hydrazine
CID 86307
1-Benzoyl-2-(4-chlorobenzoyl)hydrazine
CID 256404
1,2-Bis(4-chlorobenzoyl)-hydrazine
CID 246843
2-chloro-N'-(3-phenylpropanoyl)benzohydrazide
CID 730476
Benzoic acid, 2,4-dichloro-, 2-benzoyl-1-(1,1-dimethylethyl)hydrazide
CID 181402
Benzoic acid, 2-iodo-, 2-benzoyl-1-(1,1-dimethylethyl)hydrazide
CID 183422
N'-benzoyl-N-tert-butyl-3,5-dimethylbenzohydrazide
CID 183463
N-(tert-butyl)-4-ethyl-N'-(4-ethylbenzoyl)benzohydrazide
CID 1020604
N-tert-butyl-3,5-dimethyl-N'-(4-methylbenzoyl)benzohydrazide
CID 10449813
N'-benzoyl-N'-tert-butyl-4-ethylbenzohydrazide
CID 10663759

Frequently Asked Questions

What is the IUPAC name of N'-tert-butyl-2-chloro-N'-(2-chlorobenzoyl)benzohydrazide?
The IUPAC name of N'-tert-butyl-2-chloro-N'-(2-chlorobenzoyl)benzohydrazide (CID 15617803) is N'-tert-butyl-2-chloro-N'-(2-chlorobenzoyl)benzohydrazide.
What is the SMILES notation for N'-tert-butyl-2-chloro-N'-(2-chlorobenzoyl)benzohydrazide?
The canonical SMILES for N'-tert-butyl-2-chloro-N'-(2-chlorobenzoyl)benzohydrazide is CC(C)(C)N(NC(=O)c1ccccc1Cl)C(=O)c1ccccc1Cl.
What is the InChIKey of N'-tert-butyl-2-chloro-N'-(2-chlorobenzoyl)benzohydrazide?
The InChIKey is XYKDBVSVTYPSCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18Cl2N2O2/c1-18(2,3)22(17(24)13-9-5-7-11-15(13)20)21-16(23)12-8-4-6-10-14(12)19/h4-11H,1-3H3,(H,21,23).
What are the key properties of N'-tert-butyl-2-chloro-N'-(2-chlorobenzoyl)benzohydrazide?
N'-tert-butyl-2-chloro-N'-(2-chlorobenzoyl)benzohydrazide has a molecular weight of 365.26 g/mol, XLogP of 4.58, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-tert-butyl-2-chloro-N'-(2-chlorobenzoyl)benzohydrazide is sourced from PubChem (CID 15617803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).