Y020-8636 Screening compound: 2-methyl-2-[1-(3-morpholinopropyl)-1,2-dihydro[1,3,5]triazino[1,2-a][1,3]benzimidazol-3(4H)-yl]-1-propanol

Y020-8636 Screening compound: 2-methyl-2-[1-(3-morpholinopropyl)-1,2-dihydro[1,3,5]triazino[1,2-a][1,3]benzimidazol-3(4H)-yl]-1-propanol
Y020-8636 Screening compound: 2-methyl-2-[1-(3-morpholinopropyl)-1,2-dihydro[1,3,5]triazino[1,2-a][1,3]benzimidazol-3(4H)-yl]-1-propanol alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-8636
2-methyl-2-[1-(3-morpholinopropyl)-1,2-dihydro[1,3,5]triazino[1,2-a][1,3]benzimidazol-3(4H)-yl]-1-propanol

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

Y020-8636

Molecular Formula

C20H31N5O2 (C20 H31 N5 O2)

Compound Name

2-methyl-2-[1-(3-morpholinopropyl)-1,2-dihydro[1,3,5]triazino[1,2-a][1,3]benzimidazol-3(4H)-yl]-1-propanol

IUPAC name

2-methyl-2-{10-[3-(morpholin-4-yl)propyl]-181012-tetraazatricyclo[7.4.0.0^{27}]trideca-2468-tetraen-12-yl}propan-1-ol

SMILES

CC(C)(CO)N1CN(CCCN2CCOCC2)c2nc(cccc3)c3n2C1

InChI

InChI=1S/C20H31N5O2/c1-20(2,14-26)24-15-23(9-5-8-22-10-12-27-13-11-22)19-21-17-6-3-4-7-18(17)25(19)16-24/h3-4,6-7,26H,5,8-16H2,1-2H3

InChI Key

CXMMBGGDPOQBEI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09463479

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

373.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.545

Distribution Coefficient, logD

0.913

Water Solubility, LogSw

-2.21

Polar Surface Area

47.005

Acid Dissociation Constant (pKa)

15.98

Base Dissociation Constant (pKb)

9.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

65.00

Y020-8636 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

DGK Inhibitors Library (10558 compounds)

Nucleic Acid Ligands (8311 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with Y020-8636 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-8636?
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What is the minimum amount of Y020-8636 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-8636
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-8636
  • 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 Y020-8636 available by request