V005-9972 Screening compound: 1-({[5-(morpholin-4-yl)-3-phenyl-1,2-oxazol-4-yl]methyl}[2-(morpholin-4-yl)ethyl]amino)-3-phenylpropan-2-ol

V005-9972 Screening compound: 1-({[5-(morpholin-4-yl)-3-phenyl-1,2-oxazol-4-yl]methyl}[2-(morpholin-4-yl)ethyl]amino)-3-phenylpropan-2-ol
V005-9972 Screening compound: 1-({[5-(morpholin-4-yl)-3-phenyl-1,2-oxazol-4-yl]methyl}[2-(morpholin-4-yl)ethyl]amino)-3-phenylpropan-2-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound V005-9972
1-({[5-(morpholin-4-yl)-3-phenyl-1,2-oxazol-4-yl]methyl}[2-(morpholin-4-yl)ethyl]amino)-3-phenylpropan-2-ol

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

V005-9972

Molecular Formula

C29H38N4O4 (C29 H38 N4 O4)

Compound Name

1-({[5-(morpholin-4-yl)-3-phenyl-1,2-oxazol-4-yl]methyl}[2-(morpholin-4-yl)ethyl]amino)-3-phenylpropan-2-ol

IUPAC name

1-({[5-(morpholin-4-yl)-3-phenyl-12-oxazol-4-yl]methyl}[2-(morpholin-4-yl)ethyl]amino)-3-phenylpropan-2-ol

SMILES

OC(Cc1ccccc1)CN(CCN1CCOCC1)Cc1c(N2CCOCC2)onc1-c1ccccc1

InChI

InChI=1S/C29H38N4O4/c34-26(21-24-7-3-1-4-8-24)22-32(12-11-31-13-17-35-18-14-31)23-27-28(25-9-5-2-6-10-25)30-37-29(27)33-15-19-36-20-16-33/h1-10,26,34H,11-23H2/t26-/m0/s1

InChI Key

XHFYKLOZENYMII-SANMLTNESA-N

MDL Number (MFCD)

MFCD19879256

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

506.65

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.848

Distribution Coefficient, logD

1.331

Water Solubility, LogSw

-2.94

Polar Surface Area

66.374

Acid Dissociation Constant (pKa)

16.26

Base Dissociation Constant (pKb)

8.90

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

48.30

V005-9972 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

MCL1 Targeted Library (12200 compounds)

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with V005-9972 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V005-9972?
Check Price and Availability of V005-9972, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V005-9972 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V005-9972
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V005-9972
  • 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 V005-9972 available by request