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2-Mesylamino-4-[4-(diphenylmethoxy)piperidinomethyl]thiazole

HCID 19854940
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CS(=O)(=O)Nc1nc(CN2CCC(OC(c3ccccc3)c3ccccc3)CC2)cs1
InChIKey
RJPPKYUVEHUJPC-UHFFFAOYSA-N
Molecular formula
C23H27N3O3S2
Average molar mass
457.6 g/mol

Names & identifiers

Preferred name
2-Mesylamino-4-[4-(diphenylmethoxy)piperidinomethyl]thiazole
IUPAC
N-[4-[(4-benzhydryloxypiperidin-1-yl)methyl]-1,3-thiazol-2-yl]methanesulfonamide

Names & synonyms

SCHEMBL9676625RJPPKYUVEHUJPC-UHFFFAOYSA-N2-mesylamino-4-[4-(diphenylmethoxy)piperidinomethyl]thiazole

Database identifiers

PubChem CID
19854940

Properties

Computed structural propertiesFilling in

XLogP
3.7
Topological polar surface area
108 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
8
Heavy atoms
31
Formal charge
0
Complexity
619

Related reactions

2 records
New reaction record
HRID 1649846 reaction equation
HRID 1649846As productuspto-grants-1990_05
HRID 2340011 reaction equation
HRID 2340011As productTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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