HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

N-tert-butyl-N-[1-[2-(7,8-difluoro-2-oxoquinoxalin-1-yl)ethyl]piperidin-4-yl]carbamate

HCID 178449653
NotesReactions

Completing data — refresh the page later to see the latest

Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(C)(C)N(C(=O)[O-])C1CCN(CCn2c(=O)cnc3ccc(F)c(F)c32)CC1
InChIKey
AWOONWPEMTXWAX-UHFFFAOYSA-M
Molecular formula
C20H25F2N4O3-
Average molar mass
407.4 g/mol
Monoisotopic mass
407.189472

Names & identifiers

IUPAC
N-tert-butyl-N-[1-[2-(7,8-difluoro-2-oxoquinoxalin-1-yl)ethyl]piperidin-4-yl]carbamate

Database identifiers

PubChem CID
86652547

Properties

Computed structural propertiesFilling in

XLogP
0.6
Topological polar surface area
79.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
5
Heavy atoms
29
Formal charge
-1
Complexity
641

Related reactions

1 records
New reaction record
HRID 121124 reaction equation
HRID 121124As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes