7249-0051 Screening compound: propyl 7-(5-bromo-2-propoxyphenyl)-5-methyl-4H,7H-[1,2,3,4]tetrazolo[1,5-a]pyrimidine-6-carboxylate

7249-0051 Screening compound: propyl 7-(5-bromo-2-propoxyphenyl)-5-methyl-4H,7H-[1,2,3,4]tetrazolo[1,5-a]pyrimidine-6-carboxylate
7249-0051 Screening compound: propyl 7-(5-bromo-2-propoxyphenyl)-5-methyl-4H,7H-[1,2,3,4]tetrazolo[1,5-a]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 7249-0051
propyl 7-(5-bromo-2-propoxyphenyl)-5-methyl-4H,7H-[1,2,3,4]tetrazolo[1,5-a]pyrimidine-6-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

7249-0051

Molecular Formula

C18H22BrN5O3 (C18 H22 BrN5 O3)

Compound Name

propyl 7-(5-bromo-2-propoxyphenyl)-5-methyl-4H,7H-[1,2,3,4]tetrazolo[1,5-a]pyrimidine-6-carboxylate

IUPAC name

propyl 7-(5-bromo-2-propoxyphenyl)-5-methyl-4H7H-[1234]tetrazolo[15-a]pyrimidine-6-carboxylate

SMILES

CCCOC(C1=C(C)Nc2nnnn2C1c(cc(cc1)Br)c1OCCC)=O

InChI

InChI=1S/C18H22BrN5O3/c1-4-8-26-14-7-6-12(19)10-13(14)16-15(17(25)27-9-5-2)11(3)20-18-21-22-23-24(16)18/h6-7,10,16H,4-5,8-9H2,1-3H3,(H,20,21,23)/t16-/m0/s1

InChI Key

ZCZNSMDMXDRMQS-INIZCTEOSA-N

MDL Number (MFCD)

MFCD06009448

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

436.31

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.604

Distribution Coefficient, logD

3.647

Water Solubility, LogSw

-4.42

Polar Surface Area

81.019

Acid Dissociation Constant (pKa)

6.49

Base Dissociation Constant (pKb)

-5.33

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

44.40

References: we are preparing a list of scientific research reports with 7249-0051 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7249-0051?
Check Price and Availability of 7249-0051, 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 7249-0051 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7249-0051
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7249-0051
  • 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 7249-0051 available by request