8019-7149 Screening compound: 1-({5-[(7-methoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methyl)piperidine

8019-7149 Screening compound: 1-({5-[(7-methoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methyl)piperidine
8019-7149 Screening compound: 1-({5-[(7-methoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methyl)piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-7149
1-({5-[(7-methoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methyl)piperidine

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

8019-7149

Molecular Formula

C18H24N2O4 (C18 H24 N2 O4)

Compound Name

1-({5-[(7-methoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methyl)piperidine

IUPAC name

1-({5-[(7-methoxy-2H-13-benzodioxol-5-yl)methyl]-45-dihydro-12-oxazol-3-yl}methyl)piperidine

SMILES

COc1c2OCOc2cc(CC2ON=C(CN3CCCCC3)C2)c1

InChI

InChI=1S/C18H24N2O4/c1-21-16-8-13(9-17-18(16)23-12-22-17)7-15-10-14(19-24-15)11-20-5-3-2-4-6-20/h8-9,15H,2-7,10-12H2,1H3/t15-/m0/s1

InChI Key

PWBNIKLMOZLDGM-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD10039136

Chemical and Physical Properties

Saltdata

0.5HOOCCOOH

Molecular Weight

332.4

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.881

Distribution Coefficient, logD

2.603

Water Solubility, LogSw

-2.93

Polar Surface Area

51.141

Acid Dissociation Constant (pKa)

21.62

Base Dissociation Constant (pKb)

7.35

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

61.10

8019-7149 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS MPO Library (28609 compounds)

NOTUM (Wnt signaling) Library (3881 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system

References: we are preparing a list of scientific research reports with 8019-7149 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-7149?
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What is the minimum amount of 8019-7149 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-7149
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-7149
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 8019-7149 available by request