D643-0140 Screening compound: 9-(difluoromethyl)-2-[3-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine

D643-0140 Screening compound: 9-(difluoromethyl)-2-[3-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
D643-0140 Screening compound: 9-(difluoromethyl)-2-[3-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound D643-0140
9-(difluoromethyl)-2-[3-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine

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

D643-0140

Molecular Formula

C23H17F2N7S (C23 H17 F2 N7 S)

Compound Name

9-(difluoromethyl)-2-[3-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine

IUPAC name

13-(difluoromethyl)-4-[3-(24-dimethylphenyl)-1H-pyrazol-5-yl]-11-methyl-16-thia-356814-pentaazatetracyclo[7.7.0.0^{26}.0^{1015}]hexadeca-1(9)247101214-heptaene

SMILES

Cc(cc1)cc(C)c1-c1n[nH]c(-c2nn(cnc3c4sc5nc(C(F)F)cc(C)c35)c4n2)c1

InChI

InChI=1S/C23H17F2N7S/c1-10-4-5-13(11(2)6-10)14-8-16(30-29-14)21-28-22-19-18(26-9-32(22)31-21)17-12(3)7-15(20(24)25)27-23(17)33-19/h4-9,20H,1-3H3,(H,29,30)

InChI Key

ZORHSYFKTXWQME-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27595211

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

461.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.757

Distribution Coefficient, logD

5.750

Water Solubility, LogSw

-6.06

Polar Surface Area

62.710

Acid Dissociation Constant (pKa)

11.60

Base Dissociation Constant (pKb)

5.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

References: we are preparing a list of scientific research reports with D643-0140 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D643-0140?
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What is the minimum amount of D643-0140 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D643-0140
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D643-0140
  • 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 D643-0140 available by request