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3-Deazaneplanocin

3-Deazaneplanocin structure

CAS No:
102052-95-9
Formula:
C12H14N4O3
Chemical Name:
3-Deazaneplanocin
Synonyms:
3-Cyclopentene-1,2-diol,5-(4-amino-1H-imidazo[4,5-c]pyridin-1-yl)-3-(hydroxymethyl)-,(1S,2R,5R)-;3-Cyclopentene-1,2-diol,5-(4-amino-1H-imidazo[4,5-c]pyridin-1-yl)-3-(hydroxymethyl)-,[1S-(1α,2α,5β)]-;1H-Imidazo[4,5-c]pyridine,3-cyclopentene-1,2-diol deriv.;(1S,2R,5R)-5-(4-Amino-1H-imidazo[4,5-c]pyridin-1-yl)-3-(hydroxymethyl)-3-cyclopentene-1,2-diol;3-Deazaneplanocin A;3-Deazaneplanocin;NSC 617989;DZNeP
Categories:
Biochemical Engineering > Saccharides

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Description

DZNep (3-Deazaneplanocin A) is a potent histone methyltransferase EZH2 inhibitor.

3-Deazaneplanocin Basic Attributes

Molecular Weight：

262.27

Exact Mass：

262.26

UNII：

544SH4020S

DSSTox ID：

DTXSID30144562

Characteristics

PSA：

117

XLogP3：

1.48

Density：

1.75

Boiling Point：

624.1±65.0 °C(Predicted)

Flash Point：

281.4±32.9 °C

Refractive Index：

1.753

Vapor Pressure：

1.94E-16mmHg at 25°C

Safety Information

Precautionary statement(s)：

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H302

Drug Information

MeSH Entry Terms：

3-deaza-neplanocin

Computed Properties

Molecular Weight:262.26
XLogP3:-1.7
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:262.10659032
Monoisotopic Mass:262.10659032
Topological Polar Surface Area:117
Heavy Atom Count:19
Complexity:378
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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3-Deazaneplanocin

CAS No.: 102052-95-9

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Guide of 3-Deazaneplanocin

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties
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3-Deazaneplanocin

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