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tert-butyl N-methyl-N-[6-(2-morpholin-4-yl-4-oxochromen-8-yl)dibenzothiophen-2-yl]carbamate

HCID 68759249
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CN(C(=O)OC(C)(C)C)c1ccc2sc3c(-c4cccc5c(=O)cc(N6CCOCC6)oc45)cccc3c2c1
InChIKey
ZHXZXOVBYYCWOG-UHFFFAOYSA-N
Molecular formula
C31H30N2O5S
Average molar mass
542.6 g/mol

Names & identifiers

Preferred name
tert-butyl N-methyl-N-[6-(2-morpholin-4-yl-4-oxochromen-8-yl)dibenzothiophen-2-yl]carbamate
IUPAC
tert-butyl N-methyl-N-[6-(2-morpholin-4-yl-4-oxochromen-8-yl)dibenzothiophen-2-yl]carbamate

Names & synonyms

SCHEMBL3719419

Database identifiers

PubChem CID
68759249

Properties

Computed structural properties

XLogP
6.2
Topological polar surface area
96.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
5
Heavy atoms
39
Formal charge
0
Complexity
959

Related reactions

3 records
New reaction record
HRID 188 reaction equation
HRID 188As product750 AstraZeneca ELN dataset
HRID 189 reaction equation
HRID 189As product750 AstraZeneca ELN dataset
HRID 190 reaction equation
HRID 190As product750 AstraZeneca ELN dataset

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes