G951-0191 Screening compound: 7-(3-bromophenyl)-5-(3-chloro-4-ethoxyphenyl)-4H,5H,6H,7H-[1,2,3,4]tetrazolo[1,5-a]pyrimidine

G951-0191 Screening compound: 7-(3-bromophenyl)-5-(3-chloro-4-ethoxyphenyl)-4H,5H,6H,7H-[1,2,3,4]tetrazolo[1,5-a]pyrimidine
G951-0191 Screening compound: 7-(3-bromophenyl)-5-(3-chloro-4-ethoxyphenyl)-4H,5H,6H,7H-[1,2,3,4]tetrazolo[1,5-a]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound G951-0191
7-(3-bromophenyl)-5-(3-chloro-4-ethoxyphenyl)-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

G951-0191

Molecular Formula

C18H17BrClN5O (C18 H17 BrClN5 O)

Compound Name

7-(3-bromophenyl)-5-(3-chloro-4-ethoxyphenyl)-4H,5H,6H,7H-[1,2,3,4]tetrazolo[1,5-a]pyrimidine

IUPAC name

(5S7R)-7-(3-bromophenyl)-5-(3-chloro-4-ethoxyphenyl)-4H5H6H7H-[1234]tetrazolo[15-a]pyrimidine

SMILES

CCOc(ccc([C@@H](C1)Nc2nnnn2[C@@H]1c1cccc(Br)c1)c1)c1Cl

InChI

InChI=1S/C18H17BrClN5O/c1-2-26-17-7-6-11(9-14(17)20)15-10-16(12-4-3-5-13(19)8-12)25-18(21-15)22-23-24-25/h3-9,15-16H,2,10H2,1H3,(H,21,22,24)/t15-,16-/m0/s1

InChI Key

ANZATPZEYWOANC-HOTGVXAUSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.72

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.649

Distribution Coefficient, logD

4.649

Water Solubility, LogSw

-5.02

Polar Surface Area

60.756

Acid Dissociation Constant (pKa)

15.31

Base Dissociation Constant (pKb)

-0.77

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

27.80

G951-0191 in Drug Discovery

Included in Screening Libraries

Antiviral HBV Library (10007 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with G951-0191 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G951-0191?
Check Price and Availability of G951-0191, 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 G951-0191 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G951-0191
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G951-0191
  • 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 G951-0191 available by request