D268-0466 Screening compound: N5-(adamantan-2-yl)-N6-(3,4-dimethylphenyl)-[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine

D268-0466 Screening compound: N5-(adamantan-2-yl)-N6-(3,4-dimethylphenyl)-[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine
D268-0466 Screening compound: N5-(adamantan-2-yl)-N6-(3,4-dimethylphenyl)-[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound D268-0466
N5-(adamantan-2-yl)-N6-(3,4-dimethylphenyl)-[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine

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

D268-0466

Molecular Formula

C22H26N6O (C22 H26 N6 O)

Compound Name

N5-(adamantan-2-yl)-N6-(3,4-dimethylphenyl)-[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine

IUPAC name

N5-(adamantan-2-yl)-N6-(34-dimethylphenyl)-[125]oxadiazolo[34-b]pyrazine-56-diamine

SMILES

Cc(cc1)c(C)cc1Nc1nc2nonc2nc1NC1C2CC(C3)CC1CC3C2

InChI

InChI=1S/C22H26N6O/c1-11-3-4-17(5-12(11)2)23-19-20(26-22-21(25-19)27-29-28-22)24-18-15-7-13-6-14(9-15)10-16(18)8-13/h3-5,13-16,18H,6-10H2,1-2H3,(H,23,25,27)(H,24,26,28)

InChI Key

CZQOANCLDMVDFZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14816132

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.49

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.581

Distribution Coefficient, logD

6.581

Water Solubility, LogSw

-5.79

Polar Surface Area

76.215

Acid Dissociation Constant (pKa)

15.39

Base Dissociation Constant (pKb)

0.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

54.50

References: we are preparing a list of scientific research reports with D268-0466 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D268-0466?
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What is the minimum amount of D268-0466 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D268-0466
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D268-0466
  • 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 D268-0466 available by request