3-(5-amino-4-(3-iodobenzoyl)-1H-pyrazol-1-yl)-N-cyclopropyl-4-methylbenzamide

HCID 11167659

Basic information

Standard SMILES
Cc1ccc(C(=O)NC2CC2)cc1-n1ncc(C(=O)c2cccc(I)c2)c1N
InChIKey
OKCYOLQZTMDRPD-UHFFFAOYSA-N
Molecular formula
C21H19IN4O2
Average molar mass
486.3 g/mol
Monoisotopic mass
486.05527

Names & identifiers

Preferred name
3-(5-amino-4-(3-iodobenzoyl)-1H-pyrazol-1-yl)-N-cyclopropyl-4-methylbenzamide
IUPAC
3-[5-amino-4-(3-iodobenzoyl)pyrazol-1-yl]-N-cyclopropyl-4-methylbenzamide

Names & synonyms

3-(5-amino-4-(3-iodobenzoyl)-1H-pyrazol-1-yl)-N-cyclopropyl-4-methylbenzamide836682-66-73-[5-amino-4-(3-iodobenzoyl)-1H-pyrazol-1-yl]-N-cyclopropyl-4-methylbenzamideSCHEMBL1384896OKCYOLQZTMDRPD-UHFFFAOYSA-N3-[5-amino-4-(3-iodo-benzoyl)-pyrazol -1-yl]-N-cyclopropyl-4-methylbenzamide3-[5-Amino-4-(3-iodo-benzoyl)-pyrazol-1-yl]-N-cyclopropyl-4-methyl-benzamide3-[5-amino-4-(3-iodo-benzoyl)-pyrazol-1-yl]-N-cyclopropyl-4-methylbenzamide3-[5-amino-4-(3-iodobenzoyl)-pyrazol-1-yl]-N-cyclopropyl-4-methylbenzamide

Database identifiers

PubChem CID
11167659

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
90 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
28

Related reactions

15 records

Linked notes

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