D486-0318 Screening compound: N-[2-(morpholin-4-yl)-2-phenylethyl]-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-oxazole-3-carboxamide

D486-0318 Screening compound: N-[2-(morpholin-4-yl)-2-phenylethyl]-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-oxazole-3-carboxamide
D486-0318 Screening compound: N-[2-(morpholin-4-yl)-2-phenylethyl]-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-oxazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D486-0318
N-[2-(morpholin-4-yl)-2-phenylethyl]-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-oxazole-3-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

D486-0318

Molecular Formula

C26H29N3O3 (C26 H29 N3 O3)

Compound Name

N-[2-(morpholin-4-yl)-2-phenylethyl]-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-oxazole-3-carboxamide

IUPAC name

N-[2-(morpholin-4-yl)-2-phenylethyl]-5-(5678-tetrahydronaphthalen-2-yl)-12-oxazole-3-carboxamide

SMILES

O=C(c1noc(-c2cc(CCCC3)c3cc2)c1)NCC(c1ccccc1)N1CCOCC1

InChI

InChI=1S/C26H29N3O3/c30-26(27-18-24(20-7-2-1-3-8-20)29-12-14-31-15-13-29)23-17-25(32-28-23)22-11-10-19-6-4-5-9-21(19)16-22/h1-3,7-8,10-11,16-17,24H,4-6,9,12-15,18H2,(H,27,30)/t24-/m0/s1

InChI Key

MEBXEOIKBWYSLU-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD18076770

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

431.53

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

4.571

Distribution Coefficient, logD

4.569

Water Solubility, LogSw

-4.48

Polar Surface Area

57.005

Acid Dissociation Constant (pKa)

13.09

Base Dissociation Constant (pKb)

5.13

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.50

D486-0318 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

GPCR Targeted Library (31838 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • GPCR
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with D486-0318 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D486-0318?
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What is the minimum amount of D486-0318 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D486-0318
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D486-0318
  • 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 D486-0318 available by request