G583-1254 Screening compound: ethyl 4-{[3-(adamantan-1-yloxy)propyl]amino}-3-methyl-[1,2]oxazolo[5,4-d]pyrimidine-6-carboxylate

G583-1254 Screening compound: ethyl 4-{[3-(adamantan-1-yloxy)propyl]amino}-3-methyl-[1,2]oxazolo[5,4-d]pyrimidine-6-carboxylate
G583-1254 Screening compound: ethyl 4-{[3-(adamantan-1-yloxy)propyl]amino}-3-methyl-[1,2]oxazolo[5,4-d]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G583-1254
ethyl 4-{[3-(adamantan-1-yloxy)propyl]amino}-3-methyl-[1,2]oxazolo[5,4-d]pyrimidine-6-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

G583-1254

Molecular Formula

C22H30N4O4 (C22 H30 N4 O4)

Compound Name

ethyl 4-{[3-(adamantan-1-yloxy)propyl]amino}-3-methyl-[1,2]oxazolo[5,4-d]pyrimidine-6-carboxylate

IUPAC name

ethyl 4-{[3-(adamantan-1-yloxy)propyl]amino}-3-methyl-[12]oxazolo[54-d]pyrimidine-6-carboxylate

SMILES

CCOC(c1nc(NCCCOC2(CC(C3)C4)CC4CC3C2)c(c(C)no2)c2n1)=O

InChI

InChI=1S/C22H30N4O4/c1-3-28-21(27)19-24-18(17-13(2)26-30-20(17)25-19)23-5-4-6-29-22-10-14-7-15(11-22)9-16(8-14)12-22/h14-16H,3-12H2,1-2H3,(H,23,24,25)

InChI Key

TUZWZWFZQMXQGG-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.5

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.645

Distribution Coefficient, logD

4.645

Water Solubility, LogSw

-4.43

Polar Surface Area

78.719

Acid Dissociation Constant (pKa)

16.96

Base Dissociation Constant (pKb)

-0.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

72.70

References: we are preparing a list of scientific research reports with G583-1254 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G583-1254?
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What is the minimum amount of G583-1254 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G583-1254
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G583-1254
  • 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 G583-1254 available by request