tert-butyl N-[1-[[4-[5-[[(2-methoxybenzoyl)amino]carbamoyl]-3-(trifluoromethyl)pyrazol-1-yl]thiophen-2-yl]methylamino]-1-oxopropan-2-yl]carbamate

HCID 69299463
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Basic information

Standard SMILES
COc1ccccc1C(=O)NNC(=O)c1cc(C(F)(F)F)nn1-c1csc(CNC(=O)C(C)NC(=O)OC(C)(C)C)c1
InChIKey
ODKUNZDYOVDXKF-UHFFFAOYSA-N
Molecular formula
C26H29F3N6O6S
Average molar mass
610.6 g/mol
Monoisotopic mass
610.18213833

Names & identifiers

Preferred name
tert-butyl N-[1-[[4-[5-[[(2-methoxybenzoyl)amino]carbamoyl]-3-(trifluoromethyl)pyrazol-1-yl]thiophen-2-yl]methylamino]-1-oxopropan-2-yl]carbamate
IUPAC
tert-butyl N-[1-[[4-[5-[[(2-methoxybenzoyl)amino]carbamoyl]-3-(trifluoromethyl)pyrazol-1-yl]thiophen-2-yl]methylamino]-1-oxopropan-2-yl]carbamate

Names & synonyms

SCHEMBL5066927

Database identifiers

PubChem CID
69299463

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
181 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
11
Rotatable bonds
10
Heavy atoms
42

Related reactions

1 records
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Compound notes

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