Tert-butyl 4-(2-(3-(5-chloro-4-(4-(methylsulfonamido)phenyl)thiazol-2-yl)-1-(3,3-diphenylpropyl)ureido)ethyl)piperidine-1-carboxylate

HCID 57586321

Basic information

Standard SMILES
CC(C)(C)OC(=O)N1CCC(CCN(CCC(c2ccccc2)c2ccccc2)C(=O)Nc2nc(-c3ccc(NS(C)(=O)=O)cc3)c(Cl)s2)CC1
InChIKey
DQAJLKUMPDQDTQ-UHFFFAOYSA-N
Molecular formula
C38H46ClN5O5S2
Average molar mass
752.4 g/mol

Names & identifiers

Preferred name
Tert-butyl 4-(2-(3-(5-chloro-4-(4-(methylsulfonamido)phenyl)thiazol-2-yl)-1-(3,3-diphenylpropyl)ureido)ethyl)piperidine-1-carboxylate
IUPAC
tert-butyl 4-[2-[[5-chloro-4-[4-(methanesulfonamido)phenyl]-1,3-thiazol-2-yl]carbamoyl-(3,3-diphenylpropyl)amino]ethyl]piperidine-1-carboxylate

Names & synonyms

SCHEMBL3642204DQAJLKUMPDQDTQ-UHFFFAOYSA-Ntert-butyl 4-(2-(3-(5-chloro-4-(4-(methylsulfonamido)phenyl)thiazol-2-yl)-1-(3,3-diphenylpropyl)ureido)ethyl)piperidine-1-carboxylate

Database identifiers

PubChem CID
57586321

Properties

Computed structural properties

XLogP
7.8
Topological polar surface area
158 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
8
Rotatable bonds
14
Heavy atoms
51

Related reactions

3 records

Compound notes

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