V022-2191 Screening compound: N-(2-methoxyethyl)-N-{2-[5-(4-methoxyphenyl)-3-(4-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}cyclobutanecarboxamide

V022-2191 Screening compound: N-(2-methoxyethyl)-N-{2-[5-(4-methoxyphenyl)-3-(4-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}cyclobutanecarboxamide
V022-2191 Screening compound: N-(2-methoxyethyl)-N-{2-[5-(4-methoxyphenyl)-3-(4-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}cyclobutanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-2191
N-(2-methoxyethyl)-N-{2-[5-(4-methoxyphenyl)-3-(4-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}cyclobutanecarboxamide

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

V022-2191

Molecular Formula

C26H30N4O6 (C26 H30 N4 O6)

Compound Name

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

IUPAC name

N-(2-methoxyethyl)-N-{2-[5-(4-methoxyphenyl)-3-(4-nitrophenyl)-45-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}cyclobutanecarboxamide

SMILES

COCCN(CC(N(C(C1)c(cc2)ccc2OC)N=C1c(cc1)ccc1[N+]([O-])=O)=O)C(C1CCC1)=O

InChI

InChI=1S/C26H30N4O6/c1-35-15-14-28(26(32)20-4-3-5-20)17-25(31)29-24(19-8-12-22(36-2)13-9-19)16-23(27-29)18-6-10-21(11-7-18)30(33)34/h6-13,20,24H,3-5,14-17H2,1-2H3/t24-/m1/s1

InChI Key

MQBKNVQZVJQPSU-XMMPIXPASA-N

MDL Number (MFCD)

MFCD19807939

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

494.55

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.360

Distribution Coefficient, logD

3.360

Water Solubility, LogSw

-3.27

Polar Surface Area

92.839

Acid Dissociation Constant (pKa)

19.12

Base Dissociation Constant (pKb)

1.72

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.30

References: we are preparing a list of scientific research reports with V022-2191 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V022-2191?
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What is the minimum amount of V022-2191 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-2191
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-2191
  • 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 V022-2191 available by request