2-[(2-Thiazolylamino)carbonyl]cyclohexanecarboxylic acid
Basic information
- CAS
19692-01-4- Standard SMILES
O=C(O)C1CCCCC1C(=O)Nc1nccs1- InChIKey
WXZWNOAGMLCICB-UHFFFAOYSA-N- Molecular formula
- C11H14N2O3S
- Average molar mass
- 254.31 g/mol
- Monoisotopic mass
- 254.07251349
Names & identifiers
- Preferred name
- 2-[(2-Thiazolylamino)carbonyl]cyclohexanecarboxylic acid
- IUPAC
- 2-(1,3-thiazol-2-ylcarbamoyl)cyclohexane-1-carboxylic acid
- English name
- Cyclohexanecarboxylicacid, 2-[(2-thiazolylamino)carbonyl]-
- Molecular formula
- C11H14N2O3S
- Molecular weight
- 254.31
Names & synonyms
19692-01-42-[(2-Thiazolylamino)carbonyl]cyclohexanecarboxylic acid2-((2-Thiazolylamino)carbonyl)cyclohexanecarboxylic acidRefChem:249266cyclohexanecarboxylic acid, 2-[(2-thiazolylamino)carbonyl]-2-(1,3-thiazol-2-ylcarbamoyl)cyclohexane-1-carboxylic acidNSC 928472-[(1,3-thiazol-2-ylamino)carbonyl]cyclohexanecarboxylic acid2-[(1,3-Thiazol-2-yl)carbamoyl]cyclohexane-1-carboxylic acidNSC92847CBMicro_028176Cambridge id 5693849
Show more names
Oprea1_421801MLS000107964CHEMBL1538380Cyclohexanecarboxylicacid, 2-[(2-thiazolylamino)carbonyl]-DTXSID30293903HMS2491O15NSC-92847STK421949
Database identifiers
- CAS
19692-01-4- PubChem CID
- 260992
- DTXSID
DTXSID30293903- ChEMBL
CHEMBL1538380
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 311
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Related reactions
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Compound notes
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