Y020-2239 Screening compound: methyl 2-[3,3-dimethyl-1-oxo-11-(2,3,4-trimethoxyphenyl)-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]acetate

Y020-2239 Screening compound: methyl 2-[3,3-dimethyl-1-oxo-11-(2,3,4-trimethoxyphenyl)-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]acetate
Y020-2239 Screening compound: methyl 2-[3,3-dimethyl-1-oxo-11-(2,3,4-trimethoxyphenyl)-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-2239
methyl 2-[3,3-dimethyl-1-oxo-11-(2,3,4-trimethoxyphenyl)-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]acetate

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

Y020-2239

Molecular Formula

C27H32N2O6 (C27 H32 N2 O6)

Compound Name

methyl 2-[3,3-dimethyl-1-oxo-11-(2,3,4-trimethoxyphenyl)-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]acetate

IUPAC name

methyl 2-[1414-dimethyl-12-oxo-10-(234-trimethoxyphenyl)-29-diazatricyclo[9.4.0.0^{38}]pentadeca-1(11)3(8)46-tetraen-9-yl]acetate

SMILES

CC(C)(C1)CC(Nc(cccc2)c2N(CC(OC)=O)C2c(ccc(OC)c3OC)c3OC)=C2C1=O

InChI

InChI=1S/C27H32N2O6/c1-27(2)13-18-23(20(30)14-27)24(16-11-12-21(32-3)26(35-6)25(16)34-5)29(15-22(31)33-4)19-10-8-7-9-17(19)28-18/h7-12,24,28H,13-15H2,1-6H3/t24-/m0/s1

InChI Key

OQLSKTRDNRRNDC-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD07642578

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

480.56

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.245

Distribution Coefficient, logD

4.225

Water Solubility, LogSw

-4.41

Polar Surface Area

70.495

Acid Dissociation Constant (pKa)

8.73

Base Dissociation Constant (pKb)

1.23

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.70

Y020-2239 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin

References: we are preparing a list of scientific research reports with Y020-2239 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-2239?
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What is the minimum amount of Y020-2239 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-2239
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-2239
  • 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 Y020-2239 available by request