P149-1517 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[3-(4-fluorophenyl)-1,2-oxazol-4-yl]propanamide

P149-1517 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[3-(4-fluorophenyl)-1,2-oxazol-4-yl]propanamide
P149-1517 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[3-(4-fluorophenyl)-1,2-oxazol-4-yl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P149-1517
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[3-(4-fluorophenyl)-1,2-oxazol-4-yl]propanamide

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

P149-1517

Molecular Formula

C20H17FN2O4 (C20 H17 FN2 O4)

Compound Name

N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[3-(4-fluorophenyl)-1,2-oxazol-4-yl]propanamide

IUPAC name

N-[(2H-13-benzodioxol-5-yl)methyl]-3-[3-(4-fluorophenyl)-12-oxazol-4-yl]propanamide

SMILES

O=C(CCc1conc1-c(cc1)ccc1F)NCc(cc1)cc2c1OCO2

InChI

InChI=1S/C20H17FN2O4/c21-16-5-2-14(3-6-16)20-15(11-27-23-20)4-8-19(24)22-10-13-1-7-17-18(9-13)26-12-25-17/h1-3,5-7,9,11H,4,8,10,12H2,(H,22,24)

InChI Key

NUWVAXIEEAADQT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27566594

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.36

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.196

Distribution Coefficient, logD

3.196

Water Solubility, LogSw

-3.30

Polar Surface Area

65.554

Acid Dissociation Constant (pKa)

14.38

Base Dissociation Constant (pKb)

-0.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

P149-1517 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with P149-1517 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P149-1517?
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What is the minimum amount of P149-1517 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P149-1517
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P149-1517
  • 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 P149-1517 available by request