Basic information
- CAS
1142212-01-8- Standard SMILES
O=C(O)CN(CC(=O)N1CCN(C(=O)c2ccco2)CC1)c1ccccc1- InChIKey
HMLJIMYGABUKHJ-UHFFFAOYSA-N- Molecular formula
- C19H21N3O5
- Average molar mass
- 371.4 g/mol
- Monoisotopic mass
- 371.14812078
Names & identifiers
- Preferred name
- [{2-[4-(2-Furoyl)piperazin-1-yl]-2-oxoethyl}(phenyl)amino]acetic acid
- IUPAC
- 2-(N-[2-[4-(furan-2-carbonyl)piperazin-1-yl]-2-oxoethyl]anilino)acetic acid
- English name
- [{2-[4-(2-furoyl)piperazin-1-yl]-2-oxoethyl}(phenyl)amino]acetic acid
- Molecular formula
- C19H21N3O5
- Molecular weight
- 371.39
Names & synonyms
[{2-[4-(2-furoyl)piperazin-1-yl]-2-oxoethyl}(phenyl)amino]acetic acid1142212-01-82-(N-[2-[4-(furan-2-carbonyl)piperazin-1-yl]-2-oxoethyl]anilino)acetic acid2-((2-(4-(Furan-2-carbonyl)piperazin-1-yl)-2-oxoethyl)(phenyl)amino)acetic acidDTXSID601148407AKOS005214107[{2-[4-(Furan-2-carbonyl)piperazin-1-yl]-2-oxoethyl}(phenyl)amino]acetic acid2-((2-(4-(Furan-2-carbonyl)piperazin-1-yl)-2-oxoethyl)(phenyl)amino)aceticacidGlycine, N-[2-[4-(2-furanylcarbonyl)-1-piperazinyl]-2-oxoethyl]-N-phenyl-
Database identifiers
- CAS
1142212-01-8- PubChem CID
- 25220102
- DTXSID
DTXSID601148407
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 94.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 541
Physicochemical properties
- HazardClass
- IRRITANT
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hazard_class
- IRRITANT
Chemistry & industry
Suppliers3 total
圣克鲁斯生物技术（上海）有限公司021-60936350 · [email protected]
爱必信（上海）生物科技有限公司021-38015121-8802 · [email protected]
MATRIX[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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