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Bz-Arg-pNA · HCl

CAT: 0121-4000792.0250Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0121-4000792.0250Size:250 mg
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CAS Number
21653-40-7
Specifications
L-1130.0250
Synonyms
L-BAPA · HCl L-BApNA · HCl
Sequence
Bz-Arg-pNA · HCl
Molecular Formula
C₁₉H₂₂N₆O₄ · HCl
Molecular Weight
434.88
Shipping Conditions
Ambient Temperature
Storage Temperature
< -15°C

Chemical Information

(S)-5-(Amidinoamino)-2-(benzoylamino)-N-(4-nitrophenyl)valeramide monohydrochloride

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CAS Number21653-40-7
PubChem CID16219022
IUPAC NameN-[(2S)-5-(diaminomethylideneamino)-1-(4-nitroanilino)-1-oxopentan-2-yl]benzamide;hydrochloride
Molecular FormulaC19H23ClN6O4
Molecular Weight434.9
Topological Polar Surface Area168
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Heavy Atom Count30
Formal Charge0
Complexity588
SMILES
C1=CC=C(C=C1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-].Cl
InChI
InChI=1S/C19H22N6O4.ClH/c20-19(21)22-12-4-7-16(24-17(26)13-5-2-1-3-6-13)18(27)23-14-8-10-15(11-9-14)25(28)29;/h1-3,5-6,8-11,16H,4,7,12H2,(H,23,27)(H,24,26)(H4,20,21,22);1H/t16-;/m0./s1
InChIKey
DEOKFPFLXFNAON-NTISSMGPSA-N
Chemical Structure
2D Structure
2D structure of (S)-5-(Amidinoamino)-2-(benzoylamino)-N-(4-nitrophenyl)valeramide monohydrochloride
CAS: 21653-40-7
CID: 16219022
Formula: C19H23ClN6O4
MW: 434.9
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight434.9
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Exact Mass434.1469309
Monoisotopic Mass434.1469309
Topological Polar Surface Area168 Ų
Heavy Atom Count30
Formal Charge0
Complexity588
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
5-02417Bz-Arg-pNA·HCl
5-02447Bz-DL-Arg-pNA·HCl
GTR19186138-01Bz-D-Arg-pNA hydrochloride
SRN-3057-01Bz-L-Arg-pNA·HCl
HY-126809Bz-Pro-Phe-Arg-pNA
HY-147167Bz-D-Arg-pNA (hydrochloride)
MBS406370-01Bz-DL-Arg-pNA; HCl
FB110706-01Bz-D-Arg-pNA·HCl
MBS406303-01Bz-L-Arg-pNA; HCl
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