8010-1720 Screening compound: 3-chloro-N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-5-(4-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

8010-1720 Screening compound: 3-chloro-N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-5-(4-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
8010-1720 Screening compound: 3-chloro-N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-5-(4-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8010-1720
3-chloro-N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-5-(4-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

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

8010-1720

Molecular Formula

C28H18Cl2F3N5O5 (C28 H18 Cl2 F3 N5 O5)

Compound Name

3-chloro-N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-5-(4-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

IUPAC name

3-chloro-N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-5-(4-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[15-a]pyrimidine-2-carboxamide

SMILES

Cc(cc(cc1)Oc2cc([N+]([O-])=O)cc(NC(c3nn4c(C(F)(F)F)cc(-c(cc5)ccc5OC)nc4c3Cl)=O)c2)c1Cl

InChI

InChI=1S/C28H18Cl2F3N5O5/c1-14-9-19(7-8-21(14)29)43-20-11-16(10-17(12-20)38(40)41)34-27(39)25-24(30)26-35-22(15-3-5-18(42-2)6-4-15)13-23(28(31,32)33)37(26)36-25/h3-13H,1-2H3,(H,34,39)

InChI Key

JXRBDERMXFRPKP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01528887

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

632.38

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

8.625

Distribution Coefficient, logD

8.603

Water Solubility, LogSw

-6.98

Polar Surface Area

90.479

Acid Dissociation Constant (pKa)

8.69

Base Dissociation Constant (pKb)

0.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.70

References: we are preparing a list of scientific research reports with 8010-1720 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8010-1720?
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What is the minimum amount of 8010-1720 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8010-1720
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8010-1720
  • 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 8010-1720 available by request