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Nexturastat A

Nexturastat A structure

CAS No:
1403783-31-2
Formula:
C19 H23 N3 O3
Chemical Name:
Nexturastat A
Synonyms:
Nexturastat A;Benzamide, 4-[[butyl[(phenylamino)carbonyl]amino]methyl]-N-hydroxy-;Nexturastat A 4-((1-BUTYL-3-PHENYLUREIDO)METHYL)-N-HYDROXYBENZAMIDE;Nexturastat ABenzamide, 4-[[butyl[(phenylamino)carbonyl]amino]methyl]-N-hydroxy-;Nexturastat A, >=98%;4-[[Butyl[(phenylamino)carbonyl]amino]methyl]-N-hydroxybenzamide
Categories:
Biochemical Engineering > Inhibitors

Description

Nexturastat A is a potent and selective HDAC6 inhibitor with IC50 of 5 nM; no inhibition on other HDAC forms.IC50 value: 5 nM [1]Target: HDAC6 inhibitorNexturastat A displayed low micromolar activity compared to the low nanomolar activity against HDAC6. Moreover, it also demonstrated high levels of selective inhibition against members of the related Class 2 HDAC isozymes reaching >1000-fold selective in some cases. Compared to the pan-selective HDACI LBH589, Nexturastat A is approximatel

Nexturastat A Basic Attributes

Molecular Weight：

341.411

Exact Mass：

341.173950

Characteristics

PSA：

81.7

XLogP3：

2.6

Density：

1.228±0.06 g/cm3(Predicted)

Refractive Index：

1.622

Water Solubility：

H2O: Very slightly soluble (0.13 g/L) (25 ºC)

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|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, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Drug Information

MeSH Entry Terms：

4-((1-butyl-3-phenylureido)methyl)-N-hydroxybenzamide

Computed Properties

Molecular Weight:341.4
XLogP3:2.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:7
Exact Mass:341.17394160
Monoisotopic Mass:341.17394160
Topological Polar Surface Area:81.7
Heavy Atom Count:25
Complexity:416
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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