V028-0898 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[5-(4-methoxyphenyl)-1,2-oxazole-3-carbonyl]piperidine-2-carboxamide

V028-0898 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[5-(4-methoxyphenyl)-1,2-oxazole-3-carbonyl]piperidine-2-carboxamide
V028-0898 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[5-(4-methoxyphenyl)-1,2-oxazole-3-carbonyl]piperidine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-0898
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[5-(4-methoxyphenyl)-1,2-oxazole-3-carbonyl]piperidine-2-carboxamide

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

V028-0898

Molecular Formula

C25H25N3O6 (C25 H25 N3 O6)

Compound Name

N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[5-(4-methoxyphenyl)-1,2-oxazole-3-carbonyl]piperidine-2-carboxamide

IUPAC name

N-[(2H-13-benzodioxol-5-yl)methyl]-1-[5-(4-methoxyphenyl)-12-oxazole-3-carbonyl]piperidine-2-carboxamide

SMILES

COc(cc1)ccc1-c1cc(C(N(CCCC2)C2C(NCc(cc2)cc3c2OCO3)=O)=O)no1

InChI

InChI=1S/C25H25N3O6/c1-31-18-8-6-17(7-9-18)22-13-19(27-34-22)25(30)28-11-3-2-4-20(28)24(29)26-14-16-5-10-21-23(12-16)33-15-32-21/h5-10,12-13,20H,2-4,11,14-15H2,1H3,(H,26,29)/t20-/m0/s1

InChI Key

PTRKBXGHVGPRHK-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD19811854

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

463.49

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.395

Distribution Coefficient, logD

3.395

Water Solubility, LogSw

-3.64

Polar Surface Area

87.189

Acid Dissociation Constant (pKa)

14.30

Base Dissociation Constant (pKb)

0.36

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

32.00

References: we are preparing a list of scientific research reports with V028-0898 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-0898?
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What is the minimum amount of V028-0898 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-0898
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-0898
  • 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 V028-0898 available by request