V012-2678 Screening compound: 4-({[3-(benzyloxy)-2-hydroxypropyl][2-(morpholin-4-yl)ethyl]amino}methyl)-N,N-diethyl-3-phenyl-1,2-oxazol-5-amine

V012-2678 Screening compound: 4-({[3-(benzyloxy)-2-hydroxypropyl][2-(morpholin-4-yl)ethyl]amino}methyl)-N,N-diethyl-3-phenyl-1,2-oxazol-5-amine
V012-2678 Screening compound: 4-({[3-(benzyloxy)-2-hydroxypropyl][2-(morpholin-4-yl)ethyl]amino}methyl)-N,N-diethyl-3-phenyl-1,2-oxazol-5-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound V012-2678
4-({[3-(benzyloxy)-2-hydroxypropyl][2-(morpholin-4-yl)ethyl]amino}methyl)-N,N-diethyl-3-phenyl-1,2-oxazol-5-amine

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

V012-2678

Molecular Formula

C30H42N4O4 (C30 H42 N4 O4)

Compound Name

4-({[3-(benzyloxy)-2-hydroxypropyl][2-(morpholin-4-yl)ethyl]amino}methyl)-N,N-diethyl-3-phenyl-1,2-oxazol-5-amine

IUPAC name

4-({[3-(benzyloxy)-2-hydroxypropyl][2-(morpholin-4-yl)ethyl]amino}methyl)-NN-diethyl-3-phenyl-12-oxazol-5-amine

SMILES

CCN(CC)c1c(CN(CCN2CCOCC2)CC(COCc2ccccc2)O)c(-c2ccccc2)no1

InChI

InChI=1S/C30H42N4O4/c1-3-34(4-2)30-28(29(31-38-30)26-13-9-6-10-14-26)22-33(16-15-32-17-19-36-20-18-32)21-27(35)24-37-23-25-11-7-5-8-12-25/h5-14,27,35H,3-4,15-24H2,1-2H3/t27-/m0/s1

InChI Key

CTLCIIBEDPWTQH-MHZLTWQESA-N

MDL Number (MFCD)

MFCD19874117

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

522.69

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

15.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.523

Distribution Coefficient, logD

2.034

Water Solubility, LogSw

-3.33

Polar Surface Area

66.184

Acid Dissociation Constant (pKa)

14.75

Base Dissociation Constant (pKb)

8.88

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

V012-2678 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V012-2678 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V012-2678?
Check Price and Availability of V012-2678, 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 V012-2678 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V012-2678
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V012-2678
  • 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 V012-2678 available by request