2-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]-1-(4-nitrophenyl)propane-1,3-diol
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![2-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]-1-(4-nitrophenyl)propane-1,3-diol structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/d1219d2890a441278bb5c37ea721f875.png "2-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]-1-(4-nitrophenyl)propane-1,3-diol")
2-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]-1-(4-nitrophenyl)propane-1,3-diol
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CAS No:
1952-96-1
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Formula:
C20H23Cl2N3O4
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Chemical Name:
2-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]-1-(4-nitrophenyl)propane-1,3-diol
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Synonyms:
AT 16;BRN 3178305;1,3-Propanediol, 2-(((4-(bis(2-chloroethyl)amino)phenyl)methylene)amino)-1-(4-nitrophenyl)-;1,3-Propanediol, 2-((p-(bis(2-chloroethyl)amino)benzylidene)amino)-1-(p-nitrophenyl)-;1-(p-Nitrophenyl)-2-(p-bis(2-chloroethyl)aminobenzylidine)amino-1,3-propanediol;2-(((4-(Bis(2-chloroethyl)amino)phenyl)methylene)amino)-1-(4-nitrophenyl)-1,3-propanediol;4-14-00-00067 (Beilstein Handbook Reference);CHEMBL462221;AT-16;1952-96-1
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CAS No:
2-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]-1-(4-nitrophenyl)propane-1,3-diol Basic Attributes
440.3 g/mol
439.1065616 g/mol
Computed Properties
Molecular Weight:440.3
XLogP3:2.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:10
Exact Mass:439.1065616
Monoisotopic Mass:439.1065616
Topological Polar Surface Area:102
Heavy Atom Count:29
Complexity:498
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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