F019-0503 Screening compound: methyl 4-{6-[(2,4-dimethoxyphenyl)carbamoyl]-5-methyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}benzoate

F019-0503 Screening compound: methyl 4-{6-[(2,4-dimethoxyphenyl)carbamoyl]-5-methyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}benzoate
F019-0503 Screening compound: methyl 4-{6-[(2,4-dimethoxyphenyl)carbamoyl]-5-methyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound F019-0503
methyl 4-{6-[(2,4-dimethoxyphenyl)carbamoyl]-5-methyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}benzoate

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

F019-0503

Molecular Formula

C23H23N5O5 (C23 H23 N5 O5)

Compound Name

methyl 4-{6-[(2,4-dimethoxyphenyl)carbamoyl]-5-methyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}benzoate

IUPAC name

methyl 4-{6-[(24-dimethoxyphenyl)carbamoyl]-5-methyl-4H7H-[124]triazolo[15-a]pyrimidin-7-yl}benzoate

SMILES

CC(Nc1ncnn1C1c(cc2)ccc2C(OC)=O)=C1C(Nc(ccc(OC)c1)c1OC)=O

InChI

InChI=1S/C23H23N5O5/c1-13-19(21(29)27-17-10-9-16(31-2)11-18(17)32-3)20(28-23(26-13)24-12-25-28)14-5-7-15(8-6-14)22(30)33-4/h5-12,20H,1-4H3,(H,27,29)(H,24,25,26)/t20-/m0/s1

InChI Key

ILKNDDOHDOFVQZ-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD06002650

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

449.47

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.134

Distribution Coefficient, logD

3.132

Water Solubility, LogSw

-3.45

Polar Surface Area

96.731

Acid Dissociation Constant (pKa)

9.78

Base Dissociation Constant (pKb)

4.59

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

21.70

F019-0503 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with F019-0503 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F019-0503?
Check Price and Availability of F019-0503, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of F019-0503 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F019-0503
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F019-0503
  • 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 F019-0503 available by request