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

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

CAS No:
13331-87-8
Formula:
C23H35Cl2N3O4
Chemical Name:
ethyl 2-[(2-acetamido-4-methylpentanoyl)amino]-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoate
Synonyms:
13331-87-8;4213-38-1;NSC69830;Alanine, ethylester L-;ethyl n-acetylleucyl-4-[bis(2-chloroethyl)amino]phenylalaninate;DTXSID20962297;DTXSID70290592;NSC-69830;NSC240743;NSC-240743;ethyl 2-[(2-acetamido-4-methylpentanoyl)amino]-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoate;N-(3-{4-[Bis(2-chloroethyl)amino]phenyl}-1-ethoxy-1-oxopropan-2-yl)-2-[(1-hydroxyethylidene)amino]-4-methylpentanimidic acid

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

Molecular Weight：

488.4 g/mol

Exact Mass：

487.2004620 g/mol

NSC Number：

240743|69830

DSSTox ID：

DTXSID70290592

Characteristics

PSA：

87.7 Å²

Computed Properties

Molecular Weight:488.4
XLogP3:3.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:15
Exact Mass:487.2004620
Monoisotopic Mass:487.2004620
Topological Polar Surface Area:87.7
Heavy Atom Count:32
Complexity:578
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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

Basic Attributes
Characteristics
Computed Properties
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