8019-6965 Screening compound: 3-(2,3-dimethoxyphenyl)-N~1~-(1-methyl-1H-1,3-benzimidazol-6-yl)propanamide

8019-6965 Screening compound: 3-(2,3-dimethoxyphenyl)-N~1~-(1-methyl-1H-1,3-benzimidazol-6-yl)propanamide
8019-6965 Screening compound: 3-(2,3-dimethoxyphenyl)-N~1~-(1-methyl-1H-1,3-benzimidazol-6-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-6965
3-(2,3-dimethoxyphenyl)-N~1~-(1-methyl-1H-1,3-benzimidazol-6-yl)propanamide

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

8019-6965

Molecular Formula

C19H21N3O3 (C19 H21 N3 O3)

Compound Name

3-(2,3-dimethoxyphenyl)-N~1~-(1-methyl-1H-1,3-benzimidazol-6-yl)propanamide

IUPAC name

3-(23-dimethoxyphenyl)-N-(1-methyl-1H-13-benzodiazol-6-yl)propanamide

SMILES

Cn1c(cc(cc2)NC(CCc(cccc3OC)c3OC)=O)c2nc1

InChI

InChI=1S/C19H21N3O3/c1-22-12-20-15-9-8-14(11-16(15)22)21-18(23)10-7-13-5-4-6-17(24-2)19(13)25-3/h4-6,8-9,11-12H,7,10H2,1-3H3,(H,21,23)

InChI Key

MFXHYWALTWKYGH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10039064

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

339.39

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.817

Distribution Coefficient, logD

2.810

Water Solubility, LogSw

-3.46

Polar Surface Area

49.476

Acid Dissociation Constant (pKa)

10.29

Base Dissociation Constant (pKb)

5.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.32

8019-6965 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8019-6965 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-6965?
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What is the minimum amount of 8019-6965 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-6965
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-6965
  • 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 8019-6965 available by request