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Home > Encyclopedia > 3,4-Dihydro-5-[4-(1-piperidinyl)butoxy]-1(2H)-isoquinolinone

3,4-Dihydro-5-[4-(1-piperidinyl)butoxy]-1(2H)-isoquinolinone

3,4-Dihydro-5-[4-(1-piperidinyl)butoxy]-1(2H)-isoquinolinone structure

3,4-Dihydro-5-[4-(1-piperidinyl)butoxy]-1(2H)-isoquinolinone 

structure
  • CAS No:

    129075-73-6

  • Formula:

    C18H26N2O2

  • Chemical Name:

    3,4-Dihydro-5-[4-(1-piperidinyl)butoxy]-1(2H)-isoquinolinone

  • Synonyms:

    1(2H)-Isoquinolinone,3,4-dihydro-5-[4-(1-piperidinyl)butoxy]-;3,4-Dihydro-5-[4-(1-piperidinyl)butoxy]-1(2H)-isoquinolinone;DPQ;3,4-Dihydro-5[4-(piperidinyl)(butoxy)]-(2H)isoquinolone

3,4-Dihydro-5-[4-(1-piperidinyl)butoxy]-1(2H)-isoquinolinone Basic Attributes

302.41

302.41

5007H57E2L

DTXSID10433229

Characteristics

41.6

2.25

solid

1.096±0.06 g/cm3(Predicted)

107-109°

528.8±50.0 °C(Predicted)

273.6±30.1 °C

1.544

2-8°C

Safety Information

NONH for all modes of transport

3

36/37/38

26-36

Xi

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

H315

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, 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

Chemicals and drugs that inhibit the action of POLY(ADP-RIBOSE)POLYMERASES. (See all compounds classified as Poly(ADP-ribose) Polymerase Inhibitors.)

3,4-dihydro-5-(4-(1-piperidinyl)butoxy)-1(2H)-isoquinolinone

3,4-Dihydro-5-[4-(1-piperidinyl)butoxy]-1(2H)-isoquinolinone Use and Manufacturing

Reagent for inhibition of PARP.

Computed Properties

Molecular Weight:302.4
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:302.199428076
Monoisotopic Mass:302.199428076
Topological Polar Surface Area:41.6
Heavy Atom Count:22
Complexity:355
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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