C660-0631 Screening compound: 3-(3-chlorophenyl)-N-(2,4-difluorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine

C660-0631 Screening compound: 3-(3-chlorophenyl)-N-(2,4-difluorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine
C660-0631 Screening compound: 3-(3-chlorophenyl)-N-(2,4-difluorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound C660-0631
3-(3-chlorophenyl)-N-(2,4-difluorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-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

C660-0631

Molecular Formula

C17H9ClF2N4O (C17 H9 ClF2 N4 O)

Compound Name

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

IUPAC name

3-(3-chlorophenyl)-N-(24-difluorophenyl)-[12]oxazolo[54-d]pyrimidin-4-amine

SMILES

Fc(cc1)cc(F)c1Nc1c(c(-c2cccc(Cl)c2)no2)c2ncn1

InChI

InChI=1S/C17H9ClF2N4O/c18-10-3-1-2-9(6-10)15-14-16(21-8-22-17(14)25-24-15)23-13-5-4-11(19)7-12(13)20/h1-8H,(H,21,22,23)

InChI Key

KQULALCRSKYGSI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14780178

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

358.73

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.892

Distribution Coefficient, logD

4.892

Water Solubility, LogSw

-5.25

Polar Surface Area

51.003

Acid Dissociation Constant (pKa)

14.47

Base Dissociation Constant (pKb)

2.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

C660-0631 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with C660-0631 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C660-0631?
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What is the minimum amount of C660-0631 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C660-0631
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C660-0631
  • 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 C660-0631 available by request