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3-Cyano-N-(1,3-diphenyl-1H-pyrazol-5-yl)benzamide

3-Cyano-N-(1,3-diphenyl-1H-pyrazol-5-yl)benzamide structure

CAS No:
781652-57-1
Formula:
C23H16N4O
Chemical Name:
3-Cyano-N-(1,3-diphenyl-1H-pyrazol-5-yl)benzamide
Synonyms:
Benzamide,3-cyano-N-(1,3-diphenyl-1H-pyrazol-5-yl)-;3-Cyano-N-(1,3-diphenyl-1H-pyrazol-5-yl)benzamide;CDPPB;3-Cyano-N-(2,5-diphenylpyrazol-3-yl)benzamide;3-Cyano-N-(2,5-diphenyl-2H-pyrazol-3-yl)-benzamide

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3-Cyano-N-(1,3-diphenyl-1H-pyrazol-5-yl)benzamide Basic Attributes

Molecular Weight：

364.406

Exact Mass：

364.40

DSSTox ID：

DTXSID80459996

Characteristics

PSA：

70.7

XLogP3：

4.73628

Appearance：

white to beige

Density：

1.203g/cm3

Melting Point：

207-208 °C

Boiling Point：

523.277ºC at 760 mmHg

Flash Point：

270.268ºC

Refractive Index：

1.655

Water Solubility：

DMSO: ≥5mg/mL at warmed to 60°C

Storage Conditions：

Store at +4°C

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

Marks：

Precautionary statement(s)：

P264, P270, P301+P312, P330, P501

Hazard Statements：

H302

Drug Information

MeSH Entry Terms：

3-cyano-N-(1,3-diphenyl-1H-pyrazol-5-yl)benzamide

3-Cyano-N-(1,3-diphenyl-1H-pyrazol-5-yl)benzamide Use and Manufacturing

CDPPB is a glutamate metabotropic (mGluR5) positive allosteric modulator, used in the treatment of Phelan-McDermid syndrome caused by 22qI3 deletion. Studies have shown that CDPPB suppresses the increase of LDH release and caspase-3 activation induced by traumatic neuronal injury.

Computed Properties

Molecular Weight:364.4
XLogP3:4.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:364.13241115
Monoisotopic Mass:364.13241115
Topological Polar Surface Area:70.7
Heavy Atom Count:28
Complexity:572
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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3-Cyano-N-(1,3-diphenyl-1H-pyrazol-5-yl)benzamide

CAS No.: 781652-57-1

Content: 99.00%

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Guide of 3-Cyano-N-(1,3-diphenyl-1H-pyrazol-5-yl)benzamide

Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties
Recommended Suppliers

3-Cyano-N-(1,3-diphenyl-1H-pyrazol-5-yl)benzamide

SDS

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