Y020-1807 Screening compound: 3-(2-fluorophenyl)-11-methyl-2,3,4,5-tetrahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Y020-1807 Screening compound: 3-(2-fluorophenyl)-11-methyl-2,3,4,5-tetrahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Y020-1807 Screening compound: 3-(2-fluorophenyl)-11-methyl-2,3,4,5-tetrahydro-1H-dibenzo[b,e][1,4]diazepin-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-1807
3-(2-fluorophenyl)-11-methyl-2,3,4,5-tetrahydro-1H-dibenzo[b,e][1,4]diazepin-1-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

Y020-1807

Molecular Formula

C20H17FN2O (C20 H17 FN2 O)

Compound Name

3-(2-fluorophenyl)-11-methyl-2,3,4,5-tetrahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

IUPAC name

14-(2-fluorophenyl)-10-methyl-29-diazatricyclo[9.4.0.0^{38}]pentadeca-1(11)3579-pentaen-12-one

SMILES

CC1=Nc(cccc2)c2NC(CC(C2)c(cccc3)c3F)=C1C2=O

InChI

InChI=1S/C20H17FN2O/c1-12-20-18(23-17-9-5-4-8-16(17)22-12)10-13(11-19(20)24)14-6-2-3-7-15(14)21/h2-9,13,23H,10-11H2,1H3

InChI Key

QCOWULLMURHNHY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07181131

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

320.37

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.328

Distribution Coefficient, logD

4.211

Water Solubility, LogSw

-4.31

Polar Surface Area

31.883

Acid Dissociation Constant (pKa)

7.91

Base Dissociation Constant (pKb)

2.35

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.00

Y020-1807 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with Y020-1807 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-1807?
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What is the minimum amount of Y020-1807 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-1807
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-1807
  • 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 Y020-1807 available by request