HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

Acetamide, 2-bromo-N-[2-[(triphenylmethyl)thio]ethyl]-

HCID 11259232
New noteNew reactionRequest quotes
Print preview
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
136721-64-7
Standard SMILES
O=C(CBr)NCCSC(c1ccccc1)(c1ccccc1)c1ccccc1
InChIKey
DYLAXLLCKLPULN-UHFFFAOYSA-N
Molecular formula
C23H22BrNOS
Average molar mass
440.4 g/mol
Monoisotopic mass
439.06054742

Names & identifiers

Preferred name
Acetamide, 2-bromo-N-[2-[(triphenylmethyl)thio]ethyl]-
IUPAC
2-bromo-N-(2-tritylsulfanylethyl)acetamide

Names & synonyms

136721-64-7Acetamide, 2-bromo-N-[2-[(triphenylmethyl)thio]ethyl]-SCHEMBL975668DTXSID40460386DYLAXLLCKLPULN-UHFFFAOYSA-NBr-CH2-CONH-(CH2)2-STrtN1-(2(tritylsulfanyl)ethyl)-2-bromoacetamideN-2-Bromoacetyl-S-triphenylmethyl-2-aminoethanethiol2-Bromo-N-{2-[(triphenylmethyl)sulfanyl]ethyl}acetamide

Database identifiers

CAS
136721-64-7
PubChem CID
11259232
DTXSID
DTXSID40460386

Properties

Computed structural properties

XLogP
5.7
Topological polar surface area
54.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
8
Heavy atoms
27
Formal charge
0
Complexity
394

Related reactions

5 records
New reaction record
HRID 685895 reaction equation
HRID 685895As productTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 1227688 reaction equation
HRID 1227688As productTraining data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID 1399502 reaction equation
HRID 1399502As productuspto-grants-2014_12
HRID 1417914 reaction equation
HRID 1417914As productuspto-grants-1999_03
HRID 1830504 reaction equation
HRID 1830504As productuspto-grants-2006_06

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes