C660-1213 Screening compound: 3-(4-chlorophenyl)-5-methyl-N-(2-phenylpropyl)-[1,2]oxazolo[4,5-d]pyrimidin-7-amine

C660-1213 Screening compound: 3-(4-chlorophenyl)-5-methyl-N-(2-phenylpropyl)-[1,2]oxazolo[4,5-d]pyrimidin-7-amine
C660-1213 Screening compound: 3-(4-chlorophenyl)-5-methyl-N-(2-phenylpropyl)-[1,2]oxazolo[4,5-d]pyrimidin-7-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound C660-1213
3-(4-chlorophenyl)-5-methyl-N-(2-phenylpropyl)-[1,2]oxazolo[4,5-d]pyrimidin-7-amine

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

C660-1213

Molecular Formula

C21H19ClN4O (C21 H19 ClN4 O)

Compound Name

3-(4-chlorophenyl)-5-methyl-N-(2-phenylpropyl)-[1,2]oxazolo[4,5-d]pyrimidin-7-amine

IUPAC name

3-(4-chlorophenyl)-5-methyl-N-(2-phenylpropyl)-[12]oxazolo[45-d]pyrimidin-7-amine

SMILES

CC(CNc(nc(C)nc12)c1onc2-c(cc1)ccc1Cl)c1ccccc1

InChI

InChI=1S/C21H19ClN4O/c1-13(15-6-4-3-5-7-15)12-23-21-20-19(24-14(2)25-21)18(26-27-20)16-8-10-17(22)11-9-16/h3-11,13H,12H2,1-2H3,(H,23,24,25)/t13-/m0/s1

InChI Key

VDAUZPGBAYRNNG-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD26965266

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

378.86

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.405

Distribution Coefficient, logD

5.403

Water Solubility, LogSw

-6.22

Polar Surface Area

52.214

Acid Dissociation Constant (pKa)

17.75

Base Dissociation Constant (pKb)

5.11

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

19.00

C660-1213 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

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

Targeted Diversity Library (40567 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Nervous system
  • Cardiovascular
Agro:
  • Agro
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with C660-1213 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C660-1213?
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What is the minimum amount of C660-1213 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C660-1213
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C660-1213
  • 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 C660-1213 available by request