V006-7314 Screening compound: 3-tert-butyl-1-{2-[5-(2,5-dimethoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-1-[2-(morpholin-4-yl)ethyl]urea

V006-7314 Screening compound: 3-tert-butyl-1-{2-[5-(2,5-dimethoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-1-[2-(morpholin-4-yl)ethyl]urea
V006-7314 Screening compound: 3-tert-butyl-1-{2-[5-(2,5-dimethoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-1-[2-(morpholin-4-yl)ethyl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound V006-7314
3-tert-butyl-1-{2-[5-(2,5-dimethoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-1-[2-(morpholin-4-yl)ethyl]urea

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

V006-7314

Molecular Formula

C28H39N5O5S (C28 H39 N5 O5 S)

Compound Name

3-tert-butyl-1-{2-[5-(2,5-dimethoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-1-[2-(morpholin-4-yl)ethyl]urea

IUPAC name

3-tert-butyl-1-{2-[5-(25-dimethoxyphenyl)-3-(thiophen-2-yl)-45-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-1-[2-(morpholin-4-yl)ethyl]urea

SMILES

CC(C)(C)NC(N(CCN1CCOCC1)CC(N(C(C1)c(cc(cc2)OC)c2OC)N=C1c1cccs1)=O)=O

InChI

InChI=1S/C28H39N5O5S/c1-28(2,3)29-27(35)32(11-10-31-12-14-38-15-13-31)19-26(34)33-23(18-22(30-33)25-7-6-16-39-25)21-17-20(36-4)8-9-24(21)37-5/h6-9,16-17,23H,10-15,18-19H2,1-5H3,(H,29,35)/t23-/m1/s1

InChI Key

ZUAYRPLRJBOXRO-HSZRJFAPSA-N

MDL Number (MFCD)

MFCD19797844

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

557.71

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.852

Distribution Coefficient, logD

3.101

Water Solubility, LogSw

-4.01

Polar Surface Area

80.099

Acid Dissociation Constant (pKa)

16.59

Base Dissociation Constant (pKb)

8.07

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

53.60

References: we are preparing a list of scientific research reports with V006-7314 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V006-7314?
Check Price and Availability of V006-7314, 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 V006-7314 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V006-7314
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V006-7314
  • 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 V006-7314 available by request