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pyrextramine

pyrextramine structure

CAS No:
92588-09-5
Formula:
C26H48N6S2
Chemical Name:
pyrextramine
Synonyms:
N,N""-(dithio-2,1-ethanediyl)bis(N"-(pyrrol-2-ylmethyl)-1,6-hexanediamine);pyrextramine;CHEMBL43319;DTXSID40239054;BDBM50225364;N"-(1H-pyrrol-2-ylmethyl)-N-[2-[2-[6-(1H-pyrrol-2-ylmethylamino)hexylamino]ethyldisulfanyl]ethyl]hexane-1,6-diamine;1,6-Hexanediamine, N,N""-(dithiodi-2,1-ethanediyl)bis(N"-(1H-pyrrol-2-ylmethyl)-
Categories:
Organic Chemistry > Amides

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pyrextramine Basic Attributes

Molecular Weight：

508.832

Exact Mass：

508.338

DSSTox ID：

DTXSID40239054

Characteristics

PSA：

130

XLogP3：

2.7

Drug Information

MeSH Entry Terms：

N,N''-(dithio-2,1-ethanediyl)bis(N'-(pyrrol-2-ylmethyl)-1,6-hexanediamine)

Computed Properties

Molecular Weight:508.8
XLogP3:2.7
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:25
Exact Mass:508.33818790
Monoisotopic Mass:508.33818790
Topological Polar Surface Area:130
Heavy Atom Count:34
Complexity:394
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes