V003-2386 Screening compound: ethyl 4-{[({[3-methyl-1-(4-methylphenyl)-4-phenyl-1H-pyrazol-5-yl]carbamoyl}methyl)(propan-2-yl)carbamoyl]amino}benzoate

V003-2386 Screening compound: ethyl 4-{[({[3-methyl-1-(4-methylphenyl)-4-phenyl-1H-pyrazol-5-yl]carbamoyl}methyl)(propan-2-yl)carbamoyl]amino}benzoate
V003-2386 Screening compound: ethyl 4-{[({[3-methyl-1-(4-methylphenyl)-4-phenyl-1H-pyrazol-5-yl]carbamoyl}methyl)(propan-2-yl)carbamoyl]amino}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-2386
ethyl 4-{[({[3-methyl-1-(4-methylphenyl)-4-phenyl-1H-pyrazol-5-yl]carbamoyl}methyl)(propan-2-yl)carbamoyl]amino}benzoate

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

V003-2386

Molecular Formula

C32H35N5O4 (C32 H35 N5 O4)

Compound Name

ethyl 4-{[({[3-methyl-1-(4-methylphenyl)-4-phenyl-1H-pyrazol-5-yl]carbamoyl}methyl)(propan-2-yl)carbamoyl]amino}benzoate

IUPAC name

ethyl 4-{[({[3-methyl-1-(4-methylphenyl)-4-phenyl-1H-pyrazol-5-yl]carbamoyl}methyl)(propan-2-yl)carbamoyl]amino}benzoate

SMILES

CCOC(c(cc1)ccc1NC(N(CC(Nc(n(-c1ccc(C)cc1)nc1C)c1-c1ccccc1)=O)C(C)C)=O)=O

InChI

InChI=1S/C32H35N5O4/c1-6-41-31(39)25-14-16-26(17-15-25)33-32(40)36(21(2)3)20-28(38)34-30-29(24-10-8-7-9-11-24)23(5)35-37(30)27-18-12-22(4)13-19-27/h7-19,21H,6,20H2,1-5H3,(H,33,40)(H,34,38)

InChI Key

JLGGKCPNWBZHRK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10461860

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

553.66

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

6.142

Distribution Coefficient, logD

6.142

Water Solubility, LogSw

-5.67

Polar Surface Area

82.735

Acid Dissociation Constant (pKa)

11.79

Base Dissociation Constant (pKb)

0.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with V003-2386 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-2386?
Check Price and Availability of V003-2386, 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 V003-2386 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-2386
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-2386
  • 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 V003-2386 available by request