V005-7823 Screening compound: 1-(2-methoxyethyl)-1-{2-[5-(3-nitrophenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3-propylurea

V005-7823 Screening compound: 1-(2-methoxyethyl)-1-{2-[5-(3-nitrophenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3-propylurea
V005-7823 Screening compound: 1-(2-methoxyethyl)-1-{2-[5-(3-nitrophenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3-propylurea alternative view

Chemical Structure Depiction of ChemDiv screening compound V005-7823
1-(2-methoxyethyl)-1-{2-[5-(3-nitrophenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-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

V005-7823

Molecular Formula

C22H27N5O5S (C22 H27 N5 O5 S)

Compound Name

1-(2-methoxyethyl)-1-{2-[5-(3-nitrophenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3-propylurea

IUPAC name

1-(2-methoxyethyl)-1-{2-[5-(3-nitrophenyl)-3-(thiophen-2-yl)-45-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3-propylurea

SMILES

CCCNC(N(CCOC)CC(N(C(C1)c2cc([N+]([O-])=O)ccc2)N=C1c1cccs1)=O)=O

InChI

InChI=1S/C22H27N5O5S/c1-3-9-23-22(29)25(10-11-32-2)15-21(28)26-19(14-18(24-26)20-8-5-12-33-20)16-6-4-7-17(13-16)27(30)31/h4-8,12-13,19H,3,9-11,14-15H2,1-2H3,(H,23,29)/t19-/m1/s1

InChI Key

OLQZNVNPRPQAIT-LJQANCHMSA-N

MDL Number (MFCD)

MFCD19801060

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473.55

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.554

Distribution Coefficient, logD

3.554

Water Solubility, LogSw

-3.65

Polar Surface Area

96.046

Acid Dissociation Constant (pKa)

17.04

Base Dissociation Constant (pKb)

1.07

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.90

V005-7823 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with V005-7823 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V005-7823?
Check Price and Availability of V005-7823, 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 V005-7823 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V005-7823
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V005-7823
  • 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 V005-7823 available by request