Basic information
- CAS
58333-80-5- Standard SMILES
CCCCc1cnc(C(=O)NCCN2CCN(c3ccccc3OC)CC2)s1.Cl- InChIKey
KGWOOGMBCWFZNS-UHFFFAOYSA-N- Molecular formula
- C21H31ClN4O2S
- Average molar mass
- 439 g/mol
- Monoisotopic mass
- 438.1856251
Names & identifiers
- Preferred name
- 2-Thiazolecarboxamide, 5-butyl-N-(4-(2-(methoxyphenyl)-1-piperazinyl)ethyl)-, hydrochloride
- IUPAC
- 5-butyl-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-1,3-thiazole-2-carboxamide;hydrochloride
Names & synonyms
2-Thiazolecarboxamide, 5-butyl-N-(4-(2-(methoxyphenyl)-1-piperazinyl)ethyl)-, hydrochloride5-Butyl-N-(4-(2-(methoxyphenyl)-1-piperazinyl)ethyl)-2-thiazolecarboxamide hydrochloride58333-80-5DTXSID70207064n-Butyl-5 thiazole-2 N-beta-(o-methoxyphenyl-4' piperazino) ethyl carboxamide chlorhydrateRefChem:267258DTXCID701295555-Butyl-N-{2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl}-1,3-thiazole-2-carboxamide--hydrogen chloride (1/1)
Database identifiers
- CAS
58333-80-5- PubChem CID
- 3045138
- DTXSID
DTXSID70207064
Properties
Computed structural properties
- Topological polar surface area
- 85.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 473
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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