Ethyl trans(+/-)-2-(3-amino-4-{[(4-chloro-5-ethyl-1H-imidazol-2-yl)carbonyl]amino}piperidin-1-yl)-4-methyl-1,3-thiazole-5-carboxylate

HCID 86648554
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Basic information

Standard SMILES
CCOC(=O)c1sc(N2CC[C@@H](NC(=O)c3nc(Cl)c(CC)[nH]3)[C@H](N)C2)nc1C
InChIKey
FMEGPCLKZSCHCJ-ZYHUDNBSSA-N
Molecular formula
C18H25ClN6O3S
Average molar mass
440.9 g/mol

Names & identifiers

Preferred name
Ethyl trans(+/-)-2-(3-amino-4-{[(4-chloro-5-ethyl-1H-imidazol-2-yl)carbonyl]amino}piperidin-1-yl)-4-methyl-1,3-thiazole-5-carboxylate
IUPAC
ethyl 2-[(3R,4R)-3-amino-4-[(4-chloro-5-ethyl-1H-imidazole-2-carbonyl)amino]piperidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate

Names & synonyms

FMEGPCLKZSCHCJ-ZYHUDNBSSA-NEthyl trans(+/-)-2-(3-amino-4-{[(4-chloro-5-ethyl-1H-imidazol-2-yl)carbonyl]amino}piperidin-1-yl)-4-methyl-1,3-thiazole-5-carboxylate

Database identifiers

PubChem CID
86648554

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
154 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
8
Rotatable bonds
7
Heavy atoms
29

Related reactions

2 records
New reaction record

Compound notes

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Ethyl trans(+/-)-2-(3-amino-4-{[(4-chloro-5-ethyl-1H-imidazol-2-yl)carbonyl]amino}piperidin-1-yl)-4-methyl-1,3-thiazole-5-carboxylate (HCID 86648554)｜Huagongshe