K410-0254 Screening compound: N~1~-[2-(4-methylphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]-2-phenylbutanamide

K410-0254 Screening compound: N~1~-[2-(4-methylphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]-2-phenylbutanamide
K410-0254 Screening compound: N~1~-[2-(4-methylphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]-2-phenylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K410-0254
N~1~-[2-(4-methylphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]-2-phenylbutanamide

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

K410-0254

Molecular Formula

C22H23N3O3S (C22 H23 N3 O3 S)

Compound Name

N~1~-[2-(4-methylphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]-2-phenylbutanamide

IUPAC name

N-[2-(4-methylphenyl)-55-dioxo-2H4H6H-5lambda6-thieno[34-c]pyrazol-3-yl]-2-phenylbutanamide

SMILES

CCC(C(Nc1c(CS(C2)(=O)=O)c2nn1-c1ccc(C)cc1)=O)c1ccccc1

InChI

InChI=1S/C22H23N3O3S/c1-3-18(16-7-5-4-6-8-16)22(26)23-21-19-13-29(27,28)14-20(19)24-25(21)17-11-9-15(2)10-12-17/h4-12,18H,3,13-14H2,1-2H3,(H,23,26)/t18-/m1/s1

InChI Key

IREWZTQMWNQMGB-GOSISDBHSA-N

MDL Number (MFCD)

MFCD04452079

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.51

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.440

Distribution Coefficient, logD

3.439

Water Solubility, LogSw

-3.74

Polar Surface Area

66.701

Acid Dissociation Constant (pKa)

10.05

Base Dissociation Constant (pKb)

-2.64

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

27.30

References: we are preparing a list of scientific research reports with K410-0254 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K410-0254?
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What is the minimum amount of K410-0254 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K410-0254
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K410-0254
  • 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 K410-0254 available by request