Basic information
- CAS
154-92-7- Standard SMILES
NC(N)=NCCC[C@H](NC(=O)c1ccccc1)C(=O)O- InChIKey
RSYYQCDERUOEFI-JTQLQIEISA-N- Molecular formula
- C13H18N4O3
- Average molar mass
- 278.31 g/mol
- Monoisotopic mass
- 278.13789045
Overview
N-benzoyl-L-arginine is an N-acyl-L-arginine that is L-arginine in which one of the hydrogens attached to the alpha-amino group has been replaced by a benzoyl group. It is a N-acyl-L-arginine and a member of benzamides. It is functionally related to a benzoic acid. It is an enantiomer of a N-benzoyl-D-arginine.
Names & identifiers
- Preferred name
- Benzoyl-L-arginine
- IUPAC
- (2S)-2-benzamido-5-(diaminomethylideneamino)pentanoic acid
- English name
- N-alpha-Benzoyl-L-arginine
- Molecular formula
- C13H18N4O3
- Molecular weight
- 278.31
Names & synonyms
154-92-7Benzoyl-L-arginineN-Benzoyl-L-arginineL-Arginine, N2-benzoyl-CHEBI:90086DTXSID801315997RefChem:795100DTXCID701745874205-837-7Bz-Arg-OHN-alpha-Benzoyl-L-arginineBz-L-Arg-OH
Show more names
BZO-ARG-OHBENZOYL-ARG-OHBZ-ARGININE-OHNα-Benzoyl-L-argininen-à-benzoyl-l-arginineNα-Benzoyl-L-argininie
Nalpha-Benzoyl-L-arginineMFCD00001763N2-Benzoyl-L-arginineN~2~-(Benzenecarbonyl)-L-ArginineEINECS 205-837-7N~2~-benzoyl-L-argininealpha-N-benzoyl-L-arginineL-arginine, N~2~-benzoyl-
Database identifiers
- CAS
154-92-7- PubChem CID
- 97369
- DTXSID
DTXSID801315997- ChEMBL
CHEMBL25380- ChEBI
CHEBI:90086- UNII
- M8T3R3KR3Y
- EC Number
- 205-837-7
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 131 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 361
Physicochemical properties
- Melting point
- 281 · 281-286 °C
- Boiling point
- 421.13 °C · 421.13°C (rough estimate)
- Density
- 1.1713 · 1.1713 (rough estimate)
- refractive index
- 1.612 · 1.6120 (estimate)
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- solubility
- Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
- form
- Powder
- pka
- 3.76 · 3.76±0.10(Predicted)
- InChI
- InChI=1S/C13H18N4O3/c14-13(15)16-8-4-7-10(12(19)20)17-11(18)9-5-2-1-3-6-9/h1-3,5-6,10H,4,7-8H2,(H,17,18)(H,19,20)(H4,14,15,16)/t10-/m0/s1
- InChIKey
- RSYYQCDERUOEFI-JTQLQIEISA-N
- SMILES
- C(O)(=O)[C@H](CCCNC(N)=N)NC(=O)C1=CC=CC=C1
- CAS DataBase Reference
- 154 · 154-92-7(CAS DataBase Reference)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationL-Arginine, N2-benzoyl-: Does not have an individual approval but may be used under an appropriate group standard
Safety data
- risk_code
- 20/21/22-36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- safety_code
- 24/25-22-36-26
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Chemistry & industry
Applications
UsesN-α-Benzoyl-L-arginine can be used as as growth inhibitors in microbial antitumor screen.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers80 total
国药集团化学试剂有限公司86-21-63210123 · [email protected]
阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
江苏生康迈翔科技有限公司18217475093 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
上海哲研生物科技有限公司021-18017610038 18017610038 · [email protected]
上海腾准生物科技有限公司19821570922 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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