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HCH6-1

CAT: 0607-BA5319-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0607-BA5319-10Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1435265-06-7
Form
A solid
Molecular Formula
C28H27N3O4
Molecular Weight
469.53
Shipping Conditions
Blue ice
Storage Conditions
-20°C.

Chemical Information

Methyl benzoyl-L-tryptophyl-D-phenylalaninate
CAS Number1435265-06-7
PubChem CID71697968
IUPAC Namemethyl (2R)-2-[[(2S)-2-benzamido-3-(1H-indol-3-yl)propanoyl]amino]-3-phenylpropanoate
Molecular FormulaC28H27N3O4
Molecular Weight469.5
XLogP3.8
Topological Polar Surface Area100
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count10
Heavy Atom Count35
Formal Charge0
Complexity717
SMILES
COC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H](CC2=CNC3=CC=CC=C32)NC(=O)C4=CC=CC=C4
InChI
InChI=1S/C28H27N3O4/c1-35-28(34)25(16-19-10-4-2-5-11-19)31-27(33)24(30-26(32)20-12-6-3-7-13-20)17-21-18-29-23-15-9-8-14-22(21)23/h2-15,18,24-25,29H,16-17H2,1H3,(H,30,32)(H,31,33)/t24-,25+/m0/s1
InChIKey
MPFZAIDTRUPTSU-LOSJGSFVSA-N
Chemical Structure
2D Structure
2D structure of Methyl benzoyl-L-tryptophyl-D-phenylalaninate
CAS: 1435265-06-7
CID: 71697968
Formula: C28H27N3O4
MW: 469.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight469.5
XLogP33.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count10
Exact Mass469.20015635
Monoisotopic Mass469.20015635
Topological Polar Surface Area100 Ų
Heavy Atom Count35
Formal Charge0
Complexity717
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
T8313-01HCH6-1
HY-101283RHCH6-1 (Standard)
A20395-1HCH6-1 1mg
A20395-100HCH6-1 100mg
A20395-50HCH6-1 50mg
A20395-10HCH6-1 10mg
A20395-5HCH6-1 5mg
A20395-2HCH6-1 2mg
A20395-25HCH6-1 25mg
A20395-10mM-DHCH6-1 10mM * 1mL in DMSO

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