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7-(4-bromobutyl)-3,3,11,11-tetramethyl-1,2-dithia-5,9-diazacycloundecane;dihydrobromide

7-(4-bromobutyl)-3,3,11,11-tetramethyl-1,2-dithia-5,9-diazacycloundecane;dihydrobromide structure

CAS No:
129915-24-8
Formula:
C15H33Br3N2S2
Chemical Name:
7-(4-bromobutyl)-3,3,11,11-tetramethyl-1,2-dithia-5,9-diazacycloundecane;dihydrobromide
Synonyms:
7-(4'-bromobutyl)-3,3,11,11-tetramethyl-1,2-dithia-5,9-diazacycloundecane;7-BBTDU;129915-24-8;7-(4'-Bromobutyl)-3,3,11,11-tetramethyl-1,2-dithia-5,9-diazacycloundecane;7-Bbtdu;ACMC-20dc3o;DTXSID10156264;1,2-Dithia-5,9-diazacycloundecane,7-(4-bromobutyl)-3,3,11,11-tetramethyl-, hydrobromide (1:2)

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7-(4-bromobutyl)-3,3,11,11-tetramethyl-1,2-dithia-5,9-diazacycloundecane;dihydrobromide Basic Attributes

Molecular Weight：

545.3 g/mol

Exact Mass：

543.96148 g/mol

DSSTox ID：

DTXSID10156264

Characteristics

PSA：

74.7 Å²

Drug Information

MeSH Entry Terms：

7-(4'-bromobutyl)-3,3,11,11-tetramethyl-1,2-dithia-5,9-diazacycloundecane

Computed Properties

Molecular Weight:545.3
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:543.96148
Monoisotopic Mass:541.96353
Topological Polar Surface Area:74.7
Heavy Atom Count:22
Complexity:251
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes

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Guide of 7-(4-bromobutyl)-3,3,11,11-tetramethyl-1,2-dithia-5,9-diazacycloundecane;dihydrobromide

Basic Attributes
Characteristics
Drug Information
Computed Properties

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