G851-0138 Screening compound: 1-cyclopentyl-5-{5-[(4-methoxyphenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1H-1,2,3-benzotriazole

G851-0138 Screening compound: 1-cyclopentyl-5-{5-[(4-methoxyphenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1H-1,2,3-benzotriazole
G851-0138 Screening compound: 1-cyclopentyl-5-{5-[(4-methoxyphenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1H-1,2,3-benzotriazole alternative view

Chemical Structure Depiction of ChemDiv screening compound G851-0138
1-cyclopentyl-5-{5-[(4-methoxyphenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1H-1,2,3-benzotriazole

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

G851-0138

Molecular Formula

C21H21N5O3 (C21 H21 N5 O3)

Compound Name

1-cyclopentyl-5-{5-[(4-methoxyphenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1H-1,2,3-benzotriazole

IUPAC name

1-cyclopentyl-5-{5-[(4-methoxyphenoxy)methyl]-124-oxadiazol-3-yl}-1H-123-benzotriazole

SMILES

COc(cc1)ccc1OCc1nc(-c(cc2)cc3c2n(C2CCCC2)nn3)no1

InChI

InChI=1S/C21H21N5O3/c1-27-16-7-9-17(10-8-16)28-13-20-22-21(24-29-20)14-6-11-19-18(12-14)23-25-26(19)15-4-2-3-5-15/h6-12,15H,2-5,13H2,1H3

InChI Key

GSWHLUPWXQOIOM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15040270

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

391.43

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.372

Distribution Coefficient, logD

4.372

Water Solubility, LogSw

-4.38

Polar Surface Area

72.114

Acid Dissociation Constant (pKa)

23.88

Base Dissociation Constant (pKb)

-1.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with G851-0138 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G851-0138?
Check Price and Availability of G851-0138, 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 G851-0138 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G851-0138
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G851-0138
  • 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 G851-0138 available by request