N-glutaryl-L-phenylalanine 2-naphthylamide
Basic information
- CAS
17479-62-8- Standard SMILES
O=C(O)CCCC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccc2ccccc2c1- InChIKey
UNBPEIBIPPJZIR-NRFANRHFSA-N- Molecular formula
- C24H24N2O4
- Average molar mass
- 404.5 g/mol
- Monoisotopic mass
- 404.17360725
Overview
N-glutaryl-L-phenylalanine 2-naphthylamide is an N-(2-naphthyl)carboxamide obtained by formal condensation of the C-terminal carboxy group of N-glutaryl-L-phenylalanine with the amino group of 2-naphthylamine. It has a role as a chromogenic compound. It is a L-phenylalanine derivative and a N-(2-naphthyl)carboxamide.
Names & identifiers
- Preferred name
- N-glutaryl-L-phenylalanine 2-naphthylamide
- IUPAC
- 5-[[(2S)-1-(naphthalen-2-ylamino)-1-oxo-3-phenylpropan-2-yl]amino]-5-oxopentanoic acid
- English name
- Glutaryl-Phe-betana
- Molecular formula
- C24H24N2O4
- Molecular weight
- 404.46
Names & synonyms
17479-62-8GLUTARYL-PHE-BNAN-glutaryl-L-phenylalanine 2-naphthylamideGlutaryl-L-phenylalanine beta-naphthylamide5-[[(2S)-1-(naphthalen-2-ylamino)-1-oxo-3-phenylpropan-2-yl]amino]-5-oxopentanoic acid(S)-5-((1-(Naphthalen-2-ylamino)-1-oxo-3-phenylpropan-2-yl)amino)-5-oxopentanoic acid5-({(2S)-1-[(naphthalen-2-yl)amino]-1-oxo-3-phenylpropan-2-yl}amino)-5-oxopentanoic acidCTK8G0059Glutaryl-Phe-NACHEBI:90730DTXSID30427201FG110664
Show more names
Glutaryl-Phe-βNAGlutaryl-Phe-betanaGLUTARYL-PHENYLALANINE-BETANAN-α-Glutaryl-L-phenylalanine β-naphthylamideN-ALPHA-BENZOYL-L-PHENYLALANINE-BETA-NAPHTHYLAMIDEPentanoic acid, 5-[[(1S)-2-(2-naphthalenylamino)-2-oxo-1-(phenylmethyl)ethyl]amino]-5-oxo-
Q27162694(S)-5-((1-(Naphthalen-2-ylamino)-1-oxo-3-phenylpropan-2-yl)amino)-5-oxopentanoicacid
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 95.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 588
Physicochemical properties
- Boiling point
- 778.3 · 778.3±60.0 °C(Predicted)
- Density
- 1.274 · 1.274±0.06 g/cm3(Predicted)
- storage temp.
- Store at RT.
- pka
- 4 · 4+-.0.10(Predicted)
- Symbol(GHS)
- 8 · GHS08
- Signal word
- Danger
- Hazard statements
- 350 · H350
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H350 (100%): May cause cancer [Danger Carcinogenicity]
P203, P280, P318, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesCarc. 1A (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS08
- Hazard statements
- H350
Chemistry & industry
Applications
UsesGlutaryl-Phe-bNA is biological indicator for detrmining sterilization process.
Additional notes
DefinitionChEBI: N-glutaryl-L-phenylalanine 2-naphthylamide is an N-(2-naphthyl)carboxamide obtained by formal condensation of the C-terminal carboxy group of N-glutaryl-L-phenylalanine with the amino group of 2-naphthylamine. It has a role as a chromogenic compound. It is a N-(2-naphthyl)carboxamide and a L-phenylalanine derivative.
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