C660-1065 Screening compound: ethyl 4-[(2,2-dimethoxyethyl)(methyl)amino]-[1,2]oxazolo[5,4-d]pyrimidine-3-carboxylate

C660-1065 Screening compound: ethyl 4-[(2,2-dimethoxyethyl)(methyl)amino]-[1,2]oxazolo[5,4-d]pyrimidine-3-carboxylate
C660-1065 Screening compound: ethyl 4-[(2,2-dimethoxyethyl)(methyl)amino]-[1,2]oxazolo[5,4-d]pyrimidine-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C660-1065
ethyl 4-[(2,2-dimethoxyethyl)(methyl)amino]-[1,2]oxazolo[5,4-d]pyrimidine-3-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

C660-1065

Molecular Formula

C13H18N4O5 (C13 H18 N4 O5)

Compound Name

ethyl 4-[(2,2-dimethoxyethyl)(methyl)amino]-[1,2]oxazolo[5,4-d]pyrimidine-3-carboxylate

IUPAC name

ethyl 4-[(22-dimethoxyethyl)(methyl)amino]-[12]oxazolo[54-d]pyrimidine-3-carboxylate

SMILES

CCOC(c1noc2ncnc(N(C)CC(OC)OC)c12)=O

InChI

InChI=1S/C13H18N4O5/c1-5-21-13(18)10-9-11(14-7-15-12(9)22-16-10)17(2)6-8(19-3)20-4/h7-8H,5-6H2,1-4H3

InChI Key

RQPXGEWQPMQRJK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14780397

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

310.31

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.703

Distribution Coefficient, logD

0.703

Water Solubility, LogSw

-0.87

Polar Surface Area

81.828

Acid Dissociation Constant (pKa)

21.06

Base Dissociation Constant (pKb)

0.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

53.80

C660-1065 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with C660-1065 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C660-1065?
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What is the minimum amount of C660-1065 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C660-1065
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C660-1065
  • 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 C660-1065 available by request