V025-9423 Screening compound: N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(2-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)-3,3-dimethylbutanamide

V025-9423 Screening compound: N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(2-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)-3,3-dimethylbutanamide
V025-9423 Screening compound: N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(2-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)-3,3-dimethylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V025-9423
N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(2-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)-3,3-dimethylbutanamide

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

V025-9423

Molecular Formula

C27H32ClN3O5 (C27 H32 ClN3 O5)

Compound Name

N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(2-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)-3,3-dimethylbutanamide

IUPAC name

N-{2-[5-(2H-13-benzodioxol-5-yl)-3-(2-chlorophenyl)-45-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)-33-dimethylbutanamide

SMILES

CC(C)(C)CC(N(CCOC)CC(N(C(C1)c(cc2)cc3c2OCO3)N=C1c(cccc1)c1Cl)=O)=O

InChI

InChI=1S/C27H32ClN3O5/c1-27(2,3)15-25(32)30(11-12-34-4)16-26(33)31-22(18-9-10-23-24(13-18)36-17-35-23)14-21(29-31)19-7-5-6-8-20(19)28/h5-10,13,22H,11-12,14-17H2,1-4H3/t22-/m1/s1

InChI Key

LHPANELSLYSMEX-JOCHJYFZSA-N

MDL Number (MFCD)

MFCD19810484

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

514.02

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.042

Distribution Coefficient, logD

5.042

Water Solubility, LogSw

-5.13

Polar Surface Area

68.250

Acid Dissociation Constant (pKa)

18.73

Base Dissociation Constant (pKb)

2.33

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

44.40

References: we are preparing a list of scientific research reports with V025-9423 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V025-9423?
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What is the minimum amount of V025-9423 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V025-9423
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V025-9423
  • 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 V025-9423 available by request