Basic information
- CAS
108679-67-0- Standard SMILES
COc1ccc2nc(NC(=O)C(=O)NN)sc2c1- InChIKey
ORWBKXCJMPGWCP-UHFFFAOYSA-N- Molecular formula
- C10H10N4O3S
- Average molar mass
- 266.28 g/mol
- Monoisotopic mass
- 266.04736137
Names & identifiers
- Preferred name
- Acetic acid, ((6-methoxy-2-benzothiazolyl)amino)oxo-, hydrazide
- IUPAC
- 2-hydrazinyl-N-(6-methoxy-1,3-benzothiazol-2-yl)-2-oxoacetamide
- English name
- ACETIC ACID, ((6-METHOXY-2-BENZOTHIAZOLYL)AMINO)OXO-, HYDRAZIDE
- Molecular formula
- C10H10N4O3S
- Molecular weight
- 266.28
Names & synonyms
108679-67-0ACETIC ACID, ((6-METHOXY-2-BENZOTHIAZOLYL)AMINO)OXO-, HYDRAZIDE((6-Methoxy-2-benzothiazolyl)amino)oxoacetic acid hydrazideDTXSID70148706RefChem:316063DTXCID30711972-hydrazinyl-N-(6-methoxy-1,3-benzothiazol-2-yl)-2-oxoacetamideAKOS0221159742-hydrazinyl-N-(6-methoxybenzo[d]thiazol-2-yl)-2-oxoacetamideAcetic acid, 2-[(6-methoxy-2-benzothiazolyl)amino]-2-oxo-, hydrazide
Database identifiers
- CAS
108679-67-0- PubChem CID
- 60263
- DTXSID
DTXSID70148706
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 135 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 341
Physicochemical properties
- Density
- 1.539 · 1.539±0.06 g/cm3(Predicted)
- pka
- 7.49 · 7.49±0.70(Predicted)
- EWG's Food Scores
- 1 · 1
Chemistry & industry
Suppliers2 total
HONEST JOY HOLDINGS LIMITED[email protected]
Interbioscreen Ltd.[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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