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benzyl N-[1-[(1-amino-1-oxo-3-phenylpropan-2-yl)amino]-3-benzylsulfanyl-1-oxopropan-2-yl]carbamate

benzyl N-[1-[(1-amino-1-oxo-3-phenylpropan-2-yl)amino]-3-benzylsulfanyl-1-oxopropan-2-yl]carbamate structure

CAS No:
17327-70-7
Formula:
C27H29N3O4S
Chemical Name:
benzyl N-[1-[(1-amino-1-oxo-3-phenylpropan-2-yl)amino]-3-benzylsulfanyl-1-oxopropan-2-yl]carbamate
Synonyms:
N-Benzyloxycarbonyl-S-benzyl-Cys-Phe-amid;

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benzyl N-[1-[(1-amino-1-oxo-3-phenylpropan-2-yl)amino]-3-benzylsulfanyl-1-oxopropan-2-yl]carbamate Basic Attributes

Molecular Weight：

491.60200

Exact Mass：

491.18787759 g/mol

NSC Number：

333451

DSSTox ID：

DTXSID00318632

Characteristics

PSA：

135.82000

XLogP3：

4.90970

Density：

1.251g/cm3

Boiling Point：

785.3ºC at 760 mmHg

Flash Point：

428.7ºC

Refractive Index：

1.618

Vapor Pressure：

1.26E-24mmHg at 25°C

Computed Properties

Molecular Weight:491.6
XLogP3:3.9
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:13
Exact Mass:491.18787759
Monoisotopic Mass:491.18787759
Topological Polar Surface Area:136
Heavy Atom Count:35
Complexity:659
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of benzyl N-[1-[(1-amino-1-oxo-3-phenylpropan-2-yl)amino]-3-benzylsulfanyl-1-oxopropan-2-yl]carbamate

Basic Attributes
Characteristics
Computed Properties
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