G706-0893 Screening compound: 2-benzyl-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1,3-benzoxazole-6-carboxamide

G706-0893 Screening compound: 2-benzyl-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1,3-benzoxazole-6-carboxamide
G706-0893 Screening compound: 2-benzyl-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1,3-benzoxazole-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G706-0893
2-benzyl-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1,3-benzoxazole-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

G706-0893

Molecular Formula

C22H21N3O3 (C22 H21 N3 O3)

Compound Name

2-benzyl-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1,3-benzoxazole-6-carboxamide

IUPAC name

2-benzyl-N-[2-(35-dimethyl-12-oxazol-4-yl)ethyl]-13-benzoxazole-6-carboxamide

SMILES

Cc1noc(C)c1CCNC(c(cc1)cc2c1nc(Cc1ccccc1)o2)=O

InChI

InChI=1S/C22H21N3O3/c1-14-18(15(2)28-25-14)10-11-23-22(26)17-8-9-19-20(13-17)27-21(24-19)12-16-6-4-3-5-7-16/h3-9,13H,10-12H2,1-2H3,(H,23,26)

InChI Key

VZQOMCURJNSMQZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27152392

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

375.43

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.616

Distribution Coefficient, logD

3.616

Water Solubility, LogSw

-3.96

Polar Surface Area

63.007

Acid Dissociation Constant (pKa)

13.76

Base Dissociation Constant (pKb)

-0.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

G706-0893 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with G706-0893 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G706-0893?
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What is the minimum amount of G706-0893 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G706-0893
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G706-0893
  • 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 G706-0893 available by request