N-[(S)-2-methylhexanoyl]-alpha-L-glutamyl-5-aminopyridine-2-carbonitrile

HCID 18650752
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
CCCC[C@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)c1cc(N)cnc1C#N
InChIKey
ZPXIFTYOBKFZON-FZMZJTMJSA-N
Molecular formula
C18H24N4O4
Average molar mass
360.4 g/mol

Names & identifiers

Preferred name
N-[(S)-2-methylhexanoyl]-alpha-L-glutamyl-5-aminopyridine-2-carbonitrile
IUPAC
(4S)-5-(5-amino-2-cyano-3-pyridinyl)-4-[[(2S)-2-methylhexanoyl]amino]-5-oxopentanoic acid

Names & synonyms

ZPXIFTYOBKFZON-FZMZJTMJSA-NN-[(S)-2-methylhexanoyl]-alpha-L-glutamyl-5-aminopyridine-2-carbonitrile

Database identifiers

PubChem CID
18650752

Properties

Computed structural properties

XLogP
1.6
Topological polar surface area
146 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
7
Rotatable bonds
10
Heavy atoms
26

Related reactions

4 records
New reaction record

Compound notes

Loading…