3-[(S)-2-acetoxypropionylamino]-6-chloro-2-(4-chloropyridine-2-carbonyl)indole

HCID 54371095
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Basic information

Standard SMILES
CC(=O)O[C@@H](C)C(=O)Nc1c(C(=O)c2cc(Cl)ccn2)[nH]c2cc(Cl)ccc12
InChIKey
UTGOKZABKKFLKG-VIFPVBQESA-N
Molecular formula
C19H15Cl2N3O4
Average molar mass
420.2 g/mol

Names & identifiers

Preferred name
3-[(S)-2-acetoxypropionylamino]-6-chloro-2-(4-chloropyridine-2-carbonyl)indole
IUPAC
[(2S)-1-[[6-chloro-2-(4-chloropyridine-2-carbonyl)-1H-indol-3-yl]amino]-1-oxopropan-2-yl] acetate

Names & synonyms

SCHEMBL7506944UTGOKZABKKFLKG-VIFPVBQESA-N3-[(S)-2-acetoxypropionylamino]-6-chloro-2-(4-chloropyridine-2-carbonyl)indole3-[[(S)-2-Acetoxypropionyl]amino]-6-chloro-2-(4-chloropyridine-2-carbonyl)indole

Database identifiers

PubChem CID
54371095

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
101 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
28

Related reactions

2 records
New reaction record

Compound notes

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