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MRS 2578

MRS 2578 structure

CAS No:
711019-86-2
Formula:
C20H20N6S4
Chemical Name:
MRS 2578
Synonyms:
N,N''-1,4-BUTANEDIYLBIS[N'-(3-ISOTHIOCYANATOPHENYL)THIOUREA];MRS 2578;1,4-DI[3-(3-ISOTHIOCYANATOPHENYL)THIOUREIDO]BUTANE;N',N'''-butane-1,4-diylbis[1-(3-isothiocyanatophenyl)(thiourea)];Thiourea, N,N''-1,4-butanediylbis[N'-(3-isothiocyanatophenyl)-
Categories:
Biochemical Engineering > Inhibitors

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MRS 2578 Basic Attributes

Molecular Weight：

472.67

Exact Mass：

472.063

DSSTox ID：

DTXSID90582027

Characteristics

PSA：

201

XLogP3：

6.3

Appearance：

white solid

Density：

1.31

Boiling Point：

652.7°C at 760 mmHg

Water Solubility：

DMSO: ~17 mg/mL

Storage Conditions：

2-8°C

Safety Information

Packing level：

Ⅲ

Transport codes：

UN 2811 6.1/PG 3

wgk germany：

hazard class code：

20/21/22-36/37/38-42

safety instructions：

22-26-36/37/39-45

Marks：

Precautionary statement(s)：

P261, P264, P270, P271, P280, P285, P301+P310, P302+P352, P304+P312, P304+P340, P304+P341, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P342+P311, P362, P363, P403+P233, P405, P501

Hazard Statements：

H301

GHS Classification：

|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P285, P301+P310, P302+P352, P304+P312, P304+P340, P304+P341, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P342+P311, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

MRS 2578

Computed Properties

Molecular Weight:472.7
XLogP3:6.3
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:472.06322936
Monoisotopic Mass:472.06322936
Topological Polar Surface Area:201
Heavy Atom Count:30
Complexity:604
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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MRS 2578

CAS No.: 711019-86-2

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