Basic information
- CAS
85486-56-2- Standard SMILES
CN1CCN(C(=O)CC2(C)NC(C(=O)O)C(C)(C)S2)CC1- InChIKey
GBUMGLXNBYBLHC-UHFFFAOYSA-N- Molecular formula
- C14H25N3O3S
- Average molar mass
- 315.43 g/mol
- Monoisotopic mass
- 315.16166284
Names & identifiers
- Preferred name
- 4-Thiazolidinecarboxylic acid, 2,5,5-trimethyl-2-(2-(4-methyl-1-piperazinyl)-2-oxoethyl)-
- IUPAC
- 2,5,5-trimethyl-2-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-1,3-thiazolidine-4-carboxylic acid
- English name
- 4-Carboxy-2,5,5-trimethylthiazolidine-2-aceto-N-methylpiperazide
- Molecular formula
- C14H25N3O3S
- Molecular weight
- 315.435
Names & synonyms
85486-56-24-Carboxy-2,5,5-trimethylthiazolidine-2-aceto-N-methylpiperazide2,5,5-Trimethyl-2-(2-(4-methyl-1-piperazinyl)-2-oxoethyl)-4-thiazolidinecarboxylic acid4-Thiazolidinecarboxylic acid, 2,5,5-trimethyl-2-(2-(4-methyl-1-piperazinyl)-2-oxoethyl)-RefChem:2965472,5,5-trimethyl-2-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-1,3-thiazolidine-4-carboxylic acidDTXSID601006053
Database identifiers
- CAS
85486-56-2- PubChem CID
- 3069934
- DTXSID
DTXSID601006053
Properties
Computed structural properties
- XLogP
- -2.2
- Topological polar surface area
- 98.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 435
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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