5311-0331 Screening compound: 7-(4-methoxyphenyl)-5-methyl-N-(pyridin-3-yl)-4H,7H-[1,2,3,4]tetrazolo[1,5-a]pyrimidine-6-carboxamide

5311-0331 Screening compound: 7-(4-methoxyphenyl)-5-methyl-N-(pyridin-3-yl)-4H,7H-[1,2,3,4]tetrazolo[1,5-a]pyrimidine-6-carboxamide
5311-0331 Screening compound: 7-(4-methoxyphenyl)-5-methyl-N-(pyridin-3-yl)-4H,7H-[1,2,3,4]tetrazolo[1,5-a]pyrimidine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5311-0331
7-(4-methoxyphenyl)-5-methyl-N-(pyridin-3-yl)-4H,7H-[1,2,3,4]tetrazolo[1,5-a]pyrimidine-6-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

5311-0331

Molecular Formula

C18H17N7O2 (C18 H17 N7 O2)

Compound Name

7-(4-methoxyphenyl)-5-methyl-N-(pyridin-3-yl)-4H,7H-[1,2,3,4]tetrazolo[1,5-a]pyrimidine-6-carboxamide

IUPAC name

7-(4-methoxyphenyl)-5-methyl-N-(pyridin-3-yl)-4H7H-[1234]tetrazolo[15-a]pyrimidine-6-carboxamide

SMILES

CC(Nc1nnnn1C1c(cc2)ccc2OC)=C1C(Nc1cnccc1)=O

InChI

InChI=1S/C18H17N7O2/c1-11-15(17(26)21-13-4-3-9-19-10-13)16(25-18(20-11)22-23-24-25)12-5-7-14(27-2)8-6-12/h3-10,16H,1-2H3,(H,21,26)(H,20,22,24)/t16-/m0/s1

InChI Key

VXUUMKLNELPYTM-INIZCTEOSA-N

MDL Number (MFCD)

MFCD02370489

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

363.38

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.666

Distribution Coefficient, logD

1.650

Water Solubility, LogSw

-1.36

Polar Surface Area

92.620

Acid Dissociation Constant (pKa)

8.84

Base Dissociation Constant (pKb)

3.49

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.70

References: we are preparing a list of scientific research reports with 5311-0331 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5311-0331?
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What is the minimum amount of 5311-0331 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5311-0331
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5311-0331
  • 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 5311-0331 available by request