8019-0196 Screening compound: methyl 6-(4-hydroxybenzoyl)-7-(2-methoxyphenyl)-4,7-dihydro[1,2,3,4]tetraazolo[1,5-a]pyrimidine-5-carboxylate

8019-0196 Screening compound: methyl 6-(4-hydroxybenzoyl)-7-(2-methoxyphenyl)-4,7-dihydro[1,2,3,4]tetraazolo[1,5-a]pyrimidine-5-carboxylate
8019-0196 Screening compound: methyl 6-(4-hydroxybenzoyl)-7-(2-methoxyphenyl)-4,7-dihydro[1,2,3,4]tetraazolo[1,5-a]pyrimidine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-0196
methyl 6-(4-hydroxybenzoyl)-7-(2-methoxyphenyl)-4,7-dihydro[1,2,3,4]tetraazolo[1,5-a]pyrimidine-5-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

8019-0196

Molecular Formula

C20H17N5O5 (C20 H17 N5 O5)

Compound Name

methyl 6-(4-hydroxybenzoyl)-7-(2-methoxyphenyl)-4,7-dihydro[1,2,3,4]tetraazolo[1,5-a]pyrimidine-5-carboxylate

IUPAC name

n/a

SMILES

COC(C(Nc1nnnn1C1c(cccc2)c2OC)=C1C(c(cc1)ccc1O)=O)=O

InChI

InChI=1S/C20H17N5O5/c1-29-14-6-4-3-5-13(14)17-15(18(27)11-7-9-12(26)10-8-11)16(19(28)30-2)21-20-22-23-24-25(17)20/h3-10,17,26H,1-2H3,(H,21,22,24)/t17-/m1/s1

InChI Key

IAMNPZCQQHGFTA-QGZVFWFLSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

407.39

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.361

Distribution Coefficient, logD

1.587

Water Solubility, LogSw

-2.95

Polar Surface Area

112.856

Acid Dissociation Constant (pKa)

6.71

Base Dissociation Constant (pKb)

-4.05

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

15.00

References: we are preparing a list of scientific research reports with 8019-0196 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-0196?
Check Price and Availability of 8019-0196, 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 8019-0196 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-0196
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-0196
  • 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 8019-0196 available by request