D527-0170 Screening compound: 3-{4-ethyl-5-methyl-7-oxo-2-phenyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}-N-(2-methoxyethyl)propanamide

D527-0170 Screening compound: 3-{4-ethyl-5-methyl-7-oxo-2-phenyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}-N-(2-methoxyethyl)propanamide
D527-0170 Screening compound: 3-{4-ethyl-5-methyl-7-oxo-2-phenyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}-N-(2-methoxyethyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D527-0170
3-{4-ethyl-5-methyl-7-oxo-2-phenyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}-N-(2-methoxyethyl)propanamide

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

D527-0170

Molecular Formula

C20H25N5O3 (C20 H25 N5 O3)

Compound Name

3-{4-ethyl-5-methyl-7-oxo-2-phenyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}-N-(2-methoxyethyl)propanamide

IUPAC name

3-{4-ethyl-5-methyl-7-oxo-2-phenyl-4H7H-[124]triazolo[15-a]pyrimidin-6-yl}-N-(2-methoxyethyl)propanamide

SMILES

CCN(c1nc(-c2ccccc2)nn11)C(C)=C(CCC(NCCOC)=O)C1=O

InChI

InChI=1S/C20H25N5O3/c1-4-24-14(2)16(10-11-17(26)21-12-13-28-3)19(27)25-20(24)22-18(23-25)15-8-6-5-7-9-15/h5-9H,4,10-13H2,1-3H3,(H,21,26)

InChI Key

AGDPAQLGRBNQJI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27591129

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

383.45

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.806

Distribution Coefficient, logD

1.806

Water Solubility, LogSw

-2.14

Polar Surface Area

71.134

Acid Dissociation Constant (pKa)

13.85

Base Dissociation Constant (pKb)

-1.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

D527-0170 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D527-0170 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D527-0170?
Check Price and Availability of D527-0170, 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 D527-0170 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D527-0170
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D527-0170
  • 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 D527-0170 available by request