D274-0051 Screening compound: 3-(1-{5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}piperidin-4-yl)-1-[4-(trifluoromethyl)phenyl]urea

D274-0051 Screening compound: 3-(1-{5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}piperidin-4-yl)-1-[4-(trifluoromethyl)phenyl]urea
D274-0051 Screening compound: 3-(1-{5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}piperidin-4-yl)-1-[4-(trifluoromethyl)phenyl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound D274-0051
3-(1-{5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}piperidin-4-yl)-1-[4-(trifluoromethyl)phenyl]urea

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

D274-0051

Molecular Formula

C19H20F3N7O (C19 H20 F3 N7 O)

Compound Name

3-(1-{5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}piperidin-4-yl)-1-[4-(trifluoromethyl)phenyl]urea

IUPAC name

3-(1-{5-methyl-[124]triazolo[15-a]pyrimidin-7-yl}piperidin-4-yl)-1-[4-(trifluoromethyl)phenyl]urea

SMILES

Cc1nc2ncnn2c(N(CC2)CCC2NC(Nc2ccc(C(F)(F)F)cc2)=O)c1

InChI

InChI=1S/C19H20F3N7O/c1-12-10-16(29-17(25-12)23-11-24-29)28-8-6-15(7-9-28)27-18(30)26-14-4-2-13(3-5-14)19(20,21)22/h2-5,10-11,15H,6-9H2,1H3,(H2,26,27,30)

InChI Key

PYVBVTPYTUGORS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14816377

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.113

Distribution Coefficient, logD

3.080

Water Solubility, LogSw

-3.40

Polar Surface Area

67.488

Acid Dissociation Constant (pKa)

14.14

Base Dissociation Constant (pKb)

6.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.80

D274-0051 in Drug Discovery

Included in Screening Libraries

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with D274-0051 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D274-0051?
Check Price and Availability of D274-0051, 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 D274-0051 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D274-0051
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D274-0051
  • 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 D274-0051 available by request