N'-(2-chlorobenzoyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carbohydrazide

C24H19ClN4O3 — CID 55765038

IUPACN'-(2-chlorobenzoyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carbohydrazide
SMILESCOc1ccc(-c2cc(C(=O)NNC(=O)c3ccccc3Cl)nn2-c2ccccc2)cc1
InChIInChI=1S/C24H19ClN4O3/c1-32-18-13-11-16(12-14-18)22-15-21(28-29(22)17-7-3-2-4-8-17)24(31)27-26-23(30)19-9-5-6-10-20(19)25/h2-15H,1H3,(H,26,30)(H,27,31)
InChIKeyIQAIRFXKWOPOAZ-UHFFFAOYSA-N
MW446.89 g/mol
LogP4.28
Rot. Bonds5

About N'-(2-chlorobenzoyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carbohydrazide

N'-(2-chlorobenzoyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carbohydrazide (PubChem CID 55765038) has the molecular formula C24H19ClN4O3 and a molecular weight of 446.89 g/mol. Its IUPAC name is N'-(2-chlorobenzoyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carbohydrazide.

Molecular Properties

Compound NameN'-(2-chlorobenzoyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carbohydrazide
PubChem CID55765038
Molecular FormulaC24H19ClN4O3
Molecular Weight446.89 g/mol
Exact Mass446.11
IUPAC NameN'-(2-chlorobenzoyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carbohydrazide
SMILESCOc1ccc(-c2cc(C(=O)NNC(=O)c3ccccc3Cl)nn2-c2ccccc2)cc1
InChIInChI=1S/C24H19ClN4O3/c1-32-18-13-11-16(12-14-18)22-15-21(28-29(22)17-7-3-2-4-8-17)24(31)27-26-23(30)19-9-5-6-10-20(19)25/h2-15H,1H3,(H,26,30)(H,27,31)
InChIKeyIQAIRFXKWOPOAZ-UHFFFAOYSA-N
XLogP4.28
TPSA85.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500446.89
LogP ≤ 54.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N'-(2-chlorobenzoyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carbohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-hydroxyphenyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carboxamide
CID 52650371
N-(2-hydroxyethyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carboxamide
CID 78888374
[1,5-bis(4-methoxyphenyl)pyrazol-3-yl]-(2-methoxyphenyl)methanone
CID 14871128
5-(4-methoxyphenyl)-1-phenyl-N-(2-pyridin-2-ylethyl)pyrazole-3-carboxamide
CID 55775417
2-chloro-N'-(4-methoxybenzoyl)benzohydrazide
CID 2170875
5-(4-methoxyphenyl)-N-methyl-1-phenyl-N-propan-2-ylpyrazole-3-carboxamide
CID 166208629
5-(4-methoxyphenyl)-1-phenyl-N-[4-(prop-2-enylcarbamoylamino)phenyl]pyrazole-3-carboxamide
CID 55824547
N-[(4-methoxyphenyl)methyl]-1-phenyl-5-pyridin-4-ylpyrazole-3-carboxamide
CID 53002283
5-(4-methoxyphenyl)-N-[(5-methyl-1H-1,2,4-triazol-3-yl)methyl]-1-phenylpyrazole-3-carboxamide
CID 155947371
N-[(4-hydroxy-3-methoxyphenyl)methyl]-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carboxamide
CID 60509217
N'-(2-chlorobenzoyl)-2-(4-methoxyphenyl)-1,3-thiazole-4-carbohydrazide
CID 35929815
N-[3-(2,5-dioxopyrrolidin-1-yl)propyl]-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carboxamide
CID 56559254

Frequently Asked Questions

What is the IUPAC name of N'-(2-chlorobenzoyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carbohydrazide?
The IUPAC name of N'-(2-chlorobenzoyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carbohydrazide (CID 55765038) is N'-(2-chlorobenzoyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carbohydrazide.
What is the SMILES notation for N'-(2-chlorobenzoyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carbohydrazide?
The canonical SMILES for N'-(2-chlorobenzoyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carbohydrazide is COc1ccc(-c2cc(C(=O)NNC(=O)c3ccccc3Cl)nn2-c2ccccc2)cc1.
What is the InChIKey of N'-(2-chlorobenzoyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carbohydrazide?
The InChIKey is IQAIRFXKWOPOAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19ClN4O3/c1-32-18-13-11-16(12-14-18)22-15-21(28-29(22)17-7-3-2-4-8-17)24(31)27-26-23(30)19-9-5-6-10-20(19)25/h2-15H,1H3,(H,26,30)(H,27,31).
What are the key properties of N'-(2-chlorobenzoyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carbohydrazide?
N'-(2-chlorobenzoyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carbohydrazide has a molecular weight of 446.89 g/mol, XLogP of 4.28, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-chlorobenzoyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carbohydrazide is sourced from PubChem (CID 55765038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).