8011-6206 Screening compound: 6-(2-methoxyphenyl)-5,7-diphenyl-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one

8011-6206 Screening compound: 6-(2-methoxyphenyl)-5,7-diphenyl-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one
8011-6206 Screening compound: 6-(2-methoxyphenyl)-5,7-diphenyl-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8011-6206
6-(2-methoxyphenyl)-5,7-diphenyl-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one

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

8011-6206

Molecular Formula

C26H23N3O2 (C26 H23 N3 O2)

Compound Name

6-(2-methoxyphenyl)-5,7-diphenyl-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one

IUPAC name

6-(2-methoxyphenyl)-57-diphenyl-1H2H3H6H7H8H-pyrrolo[34-e][14]diazepin-8-one

SMILES

COc1c(C(C2=C(C3=O)NCCN=C2c2ccccc2)N3c2ccccc2)cccc1

InChI

InChI=1S/C26H23N3O2/c1-31-21-15-9-8-14-20(21)25-22-23(18-10-4-2-5-11-18)27-16-17-28-24(22)26(30)29(25)19-12-6-3-7-13-19/h2-15,25,28H,16-17H2,1H3/t25-/m0/s1

InChI Key

LUZTVNVPBUHWJN-VWLOTQADSA-N

MDL Number (MFCD)

MFCD02040001

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.49

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.168

Distribution Coefficient, logD

4.168

Water Solubility, LogSw

-4.26

Polar Surface Area

43.115

Acid Dissociation Constant (pKa)

16.14

Base Dissociation Constant (pKb)

-1.84

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

15.38

8011-6206 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8011-6206 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8011-6206?
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What is the minimum amount of 8011-6206 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8011-6206
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8011-6206
  • 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 8011-6206 available by request