V003-8004 Screening compound: 3-[3-(dimethylamino)phenyl]-4-[4-(3-methylbenzamido)phenyl]-1-(4-methylphenyl)-1H-pyrazol-5-yl acetate

V003-8004 Screening compound: 3-[3-(dimethylamino)phenyl]-4-[4-(3-methylbenzamido)phenyl]-1-(4-methylphenyl)-1H-pyrazol-5-yl acetate
V003-8004 Screening compound: 3-[3-(dimethylamino)phenyl]-4-[4-(3-methylbenzamido)phenyl]-1-(4-methylphenyl)-1H-pyrazol-5-yl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-8004
3-[3-(dimethylamino)phenyl]-4-[4-(3-methylbenzamido)phenyl]-1-(4-methylphenyl)-1H-pyrazol-5-yl acetate

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

V003-8004

Molecular Formula

C34H32N4O3 (C34 H32 N4 O3)

Compound Name

3-[3-(dimethylamino)phenyl]-4-[4-(3-methylbenzamido)phenyl]-1-(4-methylphenyl)-1H-pyrazol-5-yl acetate

IUPAC name

3-[3-(dimethylamino)phenyl]-4-[4-(3-methylbenzamido)phenyl]-1-(4-methylphenyl)-1H-pyrazol-5-yl acetate

SMILES

CC(Oc(n(-c1ccc(C)cc1)nc1-c2cc(N(C)C)ccc2)c1-c(cc1)ccc1NC(c1cc(C)ccc1)=O)=O

InChI

InChI=1S/C34H32N4O3/c1-22-12-18-29(19-13-22)38-34(41-24(3)39)31(32(36-38)26-9-7-11-30(21-26)37(4)5)25-14-16-28(17-15-25)35-33(40)27-10-6-8-23(2)20-27/h6-21H,1-5H3,(H,35,40)

InChI Key

YBQBFUCUOJKJIH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19868406

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

544.65

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

7.289

Distribution Coefficient, logD

7.282

Water Solubility, LogSw

-5.72

Polar Surface Area

60.470

Acid Dissociation Constant (pKa)

10.87

Base Dissociation Constant (pKb)

5.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.70

References: we are preparing a list of scientific research reports with V003-8004 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-8004?
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What is the minimum amount of V003-8004 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-8004
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-8004
  • 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 V003-8004 available by request