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ethyl 2-(2-acetamidopropanoylamino)-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoate

ethyl 2-(2-acetamidopropanoylamino)-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoate structure

CAS No:
13331-69-6
Formula:
C20H29Cl2N3O4
Chemical Name:
ethyl 2-(2-acetamidopropanoylamino)-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoate
Synonyms:
13331-69-6;NSC240742;DTXSID30330286;NSC-240742;Ethyl N-acetylalanyl-4-[bis(2-chloroethyl)amino]phenylalaninate

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ethyl 2-(2-acetamidopropanoylamino)-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoate Basic Attributes

Molecular Weight：

446.4 g/mol

Exact Mass：

445.1535118 g/mol

NSC Number：

240742

DSSTox ID：

DTXSID30330286

Characteristics

PSA：

87.7 Å²

Computed Properties

Molecular Weight:446.4
XLogP3:2.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:13
Exact Mass:445.1535118
Monoisotopic Mass:445.1535118
Topological Polar Surface Area:87.7
Heavy Atom Count:29
Complexity:522
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 2-(2-acetamidopropanoylamino)-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoate

Basic Attributes
Characteristics
Computed Properties
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