G951-0070 Screening compound: 7-[5-bromo-2-(difluoromethoxy)phenyl]-5-(4-ethylphenyl)-4H,5H,6H,7H-[1,2,3,4]tetrazolo[1,5-a]pyrimidine

G951-0070 Screening compound: 7-[5-bromo-2-(difluoromethoxy)phenyl]-5-(4-ethylphenyl)-4H,5H,6H,7H-[1,2,3,4]tetrazolo[1,5-a]pyrimidine
G951-0070 Screening compound: 7-[5-bromo-2-(difluoromethoxy)phenyl]-5-(4-ethylphenyl)-4H,5H,6H,7H-[1,2,3,4]tetrazolo[1,5-a]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound G951-0070
7-[5-bromo-2-(difluoromethoxy)phenyl]-5-(4-ethylphenyl)-4H,5H,6H,7H-[1,2,3,4]tetrazolo[1,5-a]pyrimidine

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

G951-0070

Molecular Formula

C19H18BrF2N5O (C19 H18 BrF2 N5 O)

Compound Name

7-[5-bromo-2-(difluoromethoxy)phenyl]-5-(4-ethylphenyl)-4H,5H,6H,7H-[1,2,3,4]tetrazolo[1,5-a]pyrimidine

IUPAC name

(5S7R)-7-[5-bromo-2-(difluoromethoxy)phenyl]-5-(4-ethylphenyl)-4H5H6H7H-[1234]tetrazolo[15-a]pyrimidine

SMILES

CCc1ccc([C@@H](C2)Nc3nnnn3[C@@H]2c(cc(cc2)Br)c2OC(F)F)cc1

InChI

InChI=1S/C19H18BrF2N5O/c1-2-11-3-5-12(6-4-11)15-10-16(27-19(23-15)24-25-26-27)14-9-13(20)7-8-17(14)28-18(21)22/h3-9,15-16,18H,2,10H2,1H3,(H,23,24,26)/t15-,16-/m0/s1

InChI Key

NALJOTGDYNGAON-HOTGVXAUSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

450.29

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.961

Distribution Coefficient, logD

4.961

Water Solubility, LogSw

-4.65

Polar Surface Area

60.237

Acid Dissociation Constant (pKa)

15.70

Base Dissociation Constant (pKb)

-0.88

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

31.60

G951-0070 in Drug Discovery

Included in Screening Libraries

Antiviral HBV Library (10007 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with G951-0070 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G951-0070?
Check Price and Availability of G951-0070, 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 G951-0070 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G951-0070
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G951-0070
  • 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 G951-0070 available by request