V026-0653 Screening compound: 1-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(2,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-1-[2-(morpholin-4-yl)ethyl]-3-propylurea

V026-0653 Screening compound: 1-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(2,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-1-[2-(morpholin-4-yl)ethyl]-3-propylurea
V026-0653 Screening compound: 1-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(2,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-1-[2-(morpholin-4-yl)ethyl]-3-propylurea alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-0653
1-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(2,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-1-[2-(morpholin-4-yl)ethyl]-3-propylurea

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

V026-0653

Molecular Formula

C30H39N5O7 (C30 H39 N5 O7)

Compound Name

1-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(2,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-1-[2-(morpholin-4-yl)ethyl]-3-propylurea

IUPAC name

1-{2-[5-(2H-13-benzodioxol-5-yl)-3-(24-dimethoxyphenyl)-45-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-1-[2-(morpholin-4-yl)ethyl]-3-propylurea

SMILES

CCCNC(N(CCN1CCOCC1)CC(N(C(C1)c(cc2)cc3c2OCO3)N=C1c(ccc(OC)c1)c1OC)=O)=O

InChI

InChI=1S/C30H39N5O7/c1-4-9-31-30(37)34(11-10-33-12-14-40-15-13-33)19-29(36)35-25(21-5-8-26-28(16-21)42-20-41-26)18-24(32-35)23-7-6-22(38-2)17-27(23)39-3/h5-8,16-17,25H,4,9-15,18-20H2,1-3H3,(H,31,37)/t25-/m0/s1

InChI Key

WTKHTMQKBJNYTQ-VWLOTQADSA-N

MDL Number (MFCD)

MFCD19797725

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

581.67

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

3.400

Distribution Coefficient, logD

2.649

Water Solubility, LogSw

-3.66

Polar Surface Area

97.213

Acid Dissociation Constant (pKa)

17.04

Base Dissociation Constant (pKb)

8.07

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with V026-0653 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-0653?
Check Price and Availability of V026-0653, 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 V026-0653 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-0653
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-0653
  • 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 V026-0653 available by request