2433-0117 Screening compound: 6-amino-3-propyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyrano[2,3-c]pyrazol-5-yl cyanide

2433-0117 Screening compound: 6-amino-3-propyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyrano[2,3-c]pyrazol-5-yl cyanide
2433-0117 Screening compound: 6-amino-3-propyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyrano[2,3-c]pyrazol-5-yl cyanide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2433-0117
6-amino-3-propyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyrano[2,3-c]pyrazol-5-yl cyanide

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

2433-0117

Molecular Formula

C17H15F3N4O (C17 H15 F3 N4 O)

Compound Name

6-amino-3-propyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyrano[2,3-c]pyrazol-5-yl cyanide

IUPAC name

6-amino-3-propyl-4-[2-(trifluoromethyl)phenyl]-1H4H-pyrano[23-c]pyrazole-5-carbonitrile

SMILES

CCCc1n[nH]c2c1C(c1c(C(F)(F)F)cccc1)C(C#N)=C(N)O2

InChI

InChI=1S/C17H15F3N4O/c1-2-5-12-14-13(9-6-3-4-7-11(9)17(18,19)20)10(8-21)15(22)25-16(14)24-23-12/h3-4,6-7,13H,2,5,22H2,1H3,(H,23,24)/t13-/m0/s1

InChI Key

WLOYJNODLQBYRT-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD01554611

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

348.33

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.431

Distribution Coefficient, logD

3.431

Water Solubility, LogSw

-3.88

Polar Surface Area

71.240

Acid Dissociation Constant (pKa)

13.26

Base Dissociation Constant (pKb)

-0.06

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.41

References: we are preparing a list of scientific research reports with 2433-0117 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2433-0117?
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What is the minimum amount of 2433-0117 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2433-0117
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2433-0117
  • 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 2433-0117 available by request