G730-0252 Screening compound: N~7~-(2-fluorobenzyl)-1,2,3,4-tetrahydropyrido[1,2-a][1,3]benzimidazole-7-carboxamide

G730-0252 Screening compound: N~7~-(2-fluorobenzyl)-1,2,3,4-tetrahydropyrido[1,2-a][1,3]benzimidazole-7-carboxamide
G730-0252 Screening compound: N~7~-(2-fluorobenzyl)-1,2,3,4-tetrahydropyrido[1,2-a][1,3]benzimidazole-7-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G730-0252
N~7~-(2-fluorobenzyl)-1,2,3,4-tetrahydropyrido[1,2-a][1,3]benzimidazole-7-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

G730-0252

Molecular Formula

C19H18FN3O (C19 H18 FN3 O)

Compound Name

N~7~-(2-fluorobenzyl)-1,2,3,4-tetrahydropyrido[1,2-a][1,3]benzimidazole-7-carboxamide

IUPAC name

N-[(2-fluorophenyl)methyl]-18-diazatricyclo[7.4.0.0^{27}]trideca-2(7)358-tetraene-5-carboxamide

SMILES

O=C(c(cc1)cc2c1n(CCCC1)c1n2)NCc(cccc1)c1F

InChI

InChI=1S/C19H18FN3O/c20-15-6-2-1-5-14(15)12-21-19(24)13-8-9-17-16(11-13)22-18-7-3-4-10-23(17)18/h1-2,5-6,8-9,11H,3-4,7,10,12H2,(H,21,24)

InChI Key

ATOQOTCUQRCDQS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15030471

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

323.37

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.330

Distribution Coefficient, logD

3.323

Water Solubility, LogSw

-3.57

Polar Surface Area

35.853

Acid Dissociation Constant (pKa)

11.75

Base Dissociation Constant (pKb)

5.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

G730-0252 in Drug Discovery

Included in Screening Libraries

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

STING Agonist Library (5895 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with G730-0252 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G730-0252?
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What is the minimum amount of G730-0252 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G730-0252
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G730-0252
  • 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 G730-0252 available by request