2-((5S)-2-(2-(1-(tert-butoxycarbonyl)piperidin-4-yl)thiazol-5-yl)-3-(3,3-dimethylbutyl)-4-oxothiazolidin-5-yl)acetic acid

HCID 57774368
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Basic information

Standard SMILES
CC(C)(C)CCN1C(=O)[C@H](CC(=O)O)SC1c1cnc(C2CCN(C(=O)OC(C)(C)C)CC2)s1
InChIKey
SBAIRVAWMDWZKV-BJQOMGFOSA-N
Molecular formula
C24H37N3O5S2
Average molar mass
511.7 g/mol

Names & identifiers

Preferred name
2-((5S)-2-(2-(1-(tert-butoxycarbonyl)piperidin-4-yl)thiazol-5-yl)-3-(3,3-dimethylbutyl)-4-oxothiazolidin-5-yl)acetic acid
IUPAC
2-[(5S)-3-(3,3-dimethylbutyl)-2-[2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]-1,3-thiazol-5-yl]-4-oxo-1,3-thiazolidin-5-yl]acetic acid

Names & synonyms

SCHEMBL2100015SBAIRVAWMDWZKV-BJQOMGFOSA-N2-((5S)-2-(2-(1-(tert-butoxycarbonyl)piperidin-4-yl)thiazol-5-yl)-3-(3,3-dimethylbutyl)-4-oxothiazolidin-5-yl)acetic acid

Database identifiers

PubChem CID
57774368

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
154 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
8
Rotatable bonds
9
Heavy atoms
34

Related reactions

2 records
New reaction record

Compound notes

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