D527-0109 Screening compound: ethyl 4-(3-{4-ethyl-5-methyl-7-oxo-2-phenyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}propanoyl)piperazine-1-carboxylate

D527-0109 Screening compound: ethyl 4-(3-{4-ethyl-5-methyl-7-oxo-2-phenyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}propanoyl)piperazine-1-carboxylate
D527-0109 Screening compound: ethyl 4-(3-{4-ethyl-5-methyl-7-oxo-2-phenyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}propanoyl)piperazine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound D527-0109
ethyl 4-(3-{4-ethyl-5-methyl-7-oxo-2-phenyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}propanoyl)piperazine-1-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

D527-0109

Molecular Formula

C24H30N6O4 (C24 H30 N6 O4)

Compound Name

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

IUPAC name

ethyl 4-(3-{4-ethyl-5-methyl-7-oxo-2-phenyl-4H7H-[124]triazolo[15-a]pyrimidin-6-yl}propanoyl)piperazine-1-carboxylate

SMILES

CCN(c1nc(-c2ccccc2)nn11)C(C)=C(CCC(N(CC2)CCN2C(OCC)=O)=O)C1=O

InChI

InChI=1S/C24H30N6O4/c1-4-29-17(3)19(11-12-20(31)27-13-15-28(16-14-27)24(33)34-5-2)22(32)30-23(29)25-21(26-30)18-9-7-6-8-10-18/h6-10H,4-5,11-16H2,1-3H3

InChI Key

UGYCWFNNXIRJTK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27591086

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

466.54

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.603

Distribution Coefficient, logD

2.603

Water Solubility, LogSw

-2.62

Polar Surface Area

77.380

Acid Dissociation Constant (pKa)

23.94

Base Dissociation Constant (pKb)

-0.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.80

References: we are preparing a list of scientific research reports with D527-0109 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D527-0109?
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What is the minimum amount of D527-0109 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D527-0109
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D527-0109
  • 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 D527-0109 available by request