K610-0424 Screening compound: propan-2-yl 2-[5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-3-amido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

K610-0424 Screening compound: propan-2-yl 2-[5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-3-amido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
K610-0424 Screening compound: propan-2-yl 2-[5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-3-amido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound K610-0424
propan-2-yl 2-[5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-3-amido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

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

K610-0424

Molecular Formula

C28H31F3N4O5S (C28 H31 F3 N4 O5 S)

Compound Name

propan-2-yl 2-[5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-3-amido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

IUPAC name

propan-2-yl 2-[(5R7S)-5-(34-dimethoxyphenyl)-7-(trifluoromethyl)-4H5H6H7H-pyrazolo[15-a]pyrimidine-3-amido]-4567-tetrahydro-1-benzothiophene-3-carboxylate

SMILES

CC(C)OC(c1c(NC(c2c(N[C@@H](C[C@@H]3C(F)(F)F)c(cc4)cc(OC)c4OC)n3nc2)=O)sc2c1CCCC2)=O

InChI

InChI=1S/C28H31F3N4O5S/c1-14(2)40-27(37)23-16-7-5-6-8-21(16)41-26(23)34-25(36)17-13-32-35-22(28(29,30)31)12-18(33-24(17)35)15-9-10-19(38-3)20(11-15)39-4/h9-11,13-14,18,22,33H,5-8,12H2,1-4H3,(H,34,36)/t18-,22-/m1/s1

InChI Key

VBTDOXXANVVQOR-XMSQKQJNSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

592.64

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

5.571

Distribution Coefficient, logD

2.808

Water Solubility, LogSw

-5.39

Polar Surface Area

84.014

Acid Dissociation Constant (pKa)

4.64

Base Dissociation Constant (pKb)

-2.90

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

46.40

References: we are preparing a list of scientific research reports with K610-0424 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K610-0424?
Check Price and Availability of K610-0424, 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 K610-0424 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K610-0424
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K610-0424
  • 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 K610-0424 available by request