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L-Alanyl-N-[(1S)-3-chloro-2-oxo-1-(phenylmethyl)propyl]-L-alaninamide

L-Alanyl-N-[(1S)-3-chloro-2-oxo-1-(phenylmethyl)propyl]-L-alaninamide structure

CAS No:
102129-66-8
Formula:
C16H22ClN3O3
Chemical Name:
L-Alanyl-N-[(1S)-3-chloro-2-oxo-1-(phenylmethyl)propyl]-L-alaninamide
Synonyms:
L-Alaninamide,L-alanyl-N-[(1S)-3-chloro-2-oxo-1-(phenylmethyl)propyl]-;L-Alaninamide,L-alanyl-N-[3-chloro-2-oxo-1-(phenylmethyl)propyl]-,(S)-;L-Alanyl-N-[(1S)-3-chloro-2-oxo-1-(phenylmethyl)propyl]-L-alaninamide

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L-Alanyl-N-[(1S)-3-chloro-2-oxo-1-(phenylmethyl)propyl]-L-alaninamide Basic Attributes

Molecular Weight：

453.84

Exact Mass：

339.82

DSSTox ID：

DTXSID60144676

Characteristics

PSA：

101

XLogP3：

2.30520

Density：

1.215g/cm3

Boiling Point：

508.9ºC at 760 mmHg

Flash Point：

261.6ºC

Refractive Index：

1.545

Vapor Pressure：

1.78E-10mmHg at 25°C

Drug Information

MeSH Entry Terms：

AAF-chloromethylketone

Computed Properties

Molecular Weight:339.82
XLogP3:1.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:8
Exact Mass:339.1349693
Monoisotopic Mass:339.1349693
Topological Polar Surface Area:101
Heavy Atom Count:23
Complexity:425
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of L-Alanyl-N-[(1S)-3-chloro-2-oxo-1-(phenylmethyl)propyl]-L-alaninamide

Basic Attributes
Characteristics
Drug Information
Computed Properties

L-Alanyl-N-[(1S)-3-chloro-2-oxo-1-(phenylmethyl)propyl]-L-alaninamide

SDS

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