K410-0729 Screening compound: N~1~-[2-(2,3-dimethylphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]-2-ethylbutanamide

K410-0729 Screening compound: N~1~-[2-(2,3-dimethylphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]-2-ethylbutanamide
K410-0729 Screening compound: N~1~-[2-(2,3-dimethylphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]-2-ethylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K410-0729
N~1~-[2-(2,3-dimethylphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]-2-ethylbutanamide

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

K410-0729

Molecular Formula

C19H25N3O3S (C19 H25 N3 O3 S)

Compound Name

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

IUPAC name

N-[2-(23-dimethylphenyl)-55-dioxo-2H4H6H-5lambda6-thieno[34-c]pyrazol-3-yl]-2-ethylbutanamide

SMILES

CCC(CC)C(Nc1c(CS(C2)(=O)=O)c2nn1-c1c(C)c(C)ccc1)=O

InChI

InChI=1S/C19H25N3O3S/c1-5-14(6-2)19(23)20-18-15-10-26(24,25)11-16(15)21-22(18)17-9-7-8-12(3)13(17)4/h7-9,14H,5-6,10-11H2,1-4H3,(H,20,23)

InChI Key

CFNKAOXWTQFUDZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04452508

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

375.49

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

3.178

Distribution Coefficient, logD

3.178

Water Solubility, LogSw

-3.38

Polar Surface Area

66.672

Acid Dissociation Constant (pKa)

10.66

Base Dissociation Constant (pKb)

-3.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.40

References: we are preparing a list of scientific research reports with K410-0729 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K410-0729?
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What is the minimum amount of K410-0729 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K410-0729
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K410-0729
  • 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 K410-0729 available by request