Arginine 4-methyl-7-coumarylamide
Basic information
- CAS
65286-27-3- Standard SMILES
Cc1cc(=O)oc2cc(NC(=O)[C@@H](N)CCCN=C(N)N)ccc12- InChIKey
ZSQPDAOJXSYJNP-LBPRGKRZSA-N- Molecular formula
- C16H21N5O3
- Average molar mass
- 331.37 g/mol
- Monoisotopic mass
- 331.16443955
Names & identifiers
- Preferred name
- Arginine 4-methyl-7-coumarylamide
- IUPAC
- (2S)-2-amino-5-(diaminomethylideneamino)-N-(4-methyl-2-oxochromen-7-yl)pentanamide
- English name
- L-Arginine 7-amido-4-methylcoumarin hydrochloride
- Molecular formula
- C16H21N5O3
- Molecular weight
- 331.37
Names & synonyms
Arginine 4-methyl-7-coumarylamide65286-27-3Arg-amcArg-4-hmecArginyl-7-amido-4-methylcoumarinArginine 4-methylcoumarinyl-7-amidePentanamide, 2-amino-5-((aminoiminomethyl)amino)-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-, (S)-RefChem:916157H-Arg-AMC70274-89-4(2S)-2-amino-5-(diaminomethylideneamino)-N-(4-methyl-2-oxochromen-7-yl)pentanamideL-R-AMC
Show more names
Arg-MCAARG-MCA HYDROCHLORIDEARG-MCA(HYDROCHLORIDE FORM)L-ARG-7-AMIDO-4-METHYLCOUMARIN HCLL-Arginine 7-amido-4-methylcoumarin hydrochlorideL-ARGININE 4-METHYLCOUMARYL-7-AMIDE HYDROCHLORIDEPentanamide, 2-amino-5-[(aminoiminomethyl)amino]-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-, (2S)-
(S)-2-Amino-5-guanidino-N-(4-methyl-2-oxo-2H-chromen-7-yl)pentanamideL-Arg-AMCH-Arg-AMC, HCl saltSCHEMBL2230757SCHEMBL29543705SCHEMBL30362826DTXSID00215632N-(4-Methyl-2-oxo-2H-1-benzopyran-7-yl)-L-argininamide
Database identifiers
- CAS
65286-27-3- PubChem CID
- 196428
- DTXSID
DTXSID00215632- Nikkaji
- J850.784H
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 146 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 542
Physicochemical properties
- Density
- 1.422 · 1.422±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- storage temp.
- 20 °C · −20°C
- pka
- 12.92 · 12.920±0.20(predicted)
- WGK Germany
- 3 · 3
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
- wgk
- 3
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Compound notes
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