V003-4274 Screening compound: 1-(allyloxy)-3-{benzyl[(1-methyl-5-phenoxy-3-phenyl-1H-pyrazol-4-yl)methyl]amino}-2-propanol

V003-4274 Screening compound: 1-(allyloxy)-3-{benzyl[(1-methyl-5-phenoxy-3-phenyl-1H-pyrazol-4-yl)methyl]amino}-2-propanol
V003-4274 Screening compound: 1-(allyloxy)-3-{benzyl[(1-methyl-5-phenoxy-3-phenyl-1H-pyrazol-4-yl)methyl]amino}-2-propanol alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-4274
1-(allyloxy)-3-{benzyl[(1-methyl-5-phenoxy-3-phenyl-1H-pyrazol-4-yl)methyl]amino}-2-propanol

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

V003-4274

Molecular Formula

C30H33N3O3 (C30 H33 N3 O3)

Compound Name

1-(allyloxy)-3-{benzyl[(1-methyl-5-phenoxy-3-phenyl-1H-pyrazol-4-yl)methyl]amino}-2-propanol

IUPAC name

benzyl[2-hydroxy-3-(prop-2-en-1-yloxy)propyl][(1-methyl-5-phenoxy-3-phenyl-1H-pyrazol-4-yl)methyl]amine

SMILES

Cn(c(Oc1ccccc1)c1CN(CC(COCC=C)O)Cc2ccccc2)nc1-c1ccccc1

InChI

InChI=1S/C30H33N3O3/c1-3-19-35-23-26(34)21-33(20-24-13-7-4-8-14-24)22-28-29(25-15-9-5-10-16-25)31-32(2)30(28)36-27-17-11-6-12-18-27/h3-18,26,34H,1,19-23H2,2H3/t26-/m0/s1

InChI Key

OENWHQJLFQNDGX-SANMLTNESA-N

MDL Number (MFCD)

MFCD19884845

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

483.61

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.848

Distribution Coefficient, logD

3.732

Water Solubility, LogSw

-4.54

Polar Surface Area

49.948

Acid Dissociation Constant (pKa)

14.75

Base Dissociation Constant (pKb)

8.48

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.33

References: we are preparing a list of scientific research reports with V003-4274 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-4274?
Check Price and Availability of V003-4274, 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 V003-4274 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-4274
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-4274
  • 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 V003-4274 available by request