6583-0087 Screening compound: 2-[(2-HYDROXYETHYL)(5-MORPHOLINO-1,2,3,4-TETRAHYDROPYRIMIDO[4',5':4,5]THIENO[2,3-C]ISOQUINOLIN-8-YL)AMINO]-1-ETHANOL

6583-0087 Screening compound: 2-[(2-HYDROXYETHYL)(5-MORPHOLINO-1,2,3,4-TETRAHYDROPYRIMIDO[4',5':4,5]THIENO[2,3-C]ISOQUINOLIN-8-YL)AMINO]-1-ETHANOL
6583-0087 Screening compound: 2-[(2-HYDROXYETHYL)(5-MORPHOLINO-1,2,3,4-TETRAHYDROPYRIMIDO[4',5':4,5]THIENO[2,3-C]ISOQUINOLIN-8-YL)AMINO]-1-ETHANOL alternative view

Chemical Structure Depiction of ChemDiv screening compound 6583-0087
2-[(2-HYDROXYETHYL)(5-MORPHOLINO-1,2,3,4-TETRAHYDROPYRIMIDO[4',5':4,5]THIENO[2,3-C]ISOQUINOLIN-8-YL)AMINO]-1-ETHANOL

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

6583-0087

Molecular Formula

C21H27N5O3S (C21 H27 N5 O3 S)

Compound Name

2-[(2-HYDROXYETHYL)(5-MORPHOLINO-1,2,3,4-TETRAHYDROPYRIMIDO[4',5':4,5]THIENO[2,3-C]ISOQUINOLIN-8-YL)AMINO]-1-ETHANOL

IUPAC name

n/a

SMILES

OCCN(CCO)c1c2sc3nc(N4CCOCC4)c(CCCC4)c4c3c2ncn1

InChI

InChI=1S/C21H27N5O3S/c27-9-5-25(6-10-28)20-18-17(22-13-23-20)16-14-3-1-2-4-15(14)19(24-21(16)30-18)26-7-11-29-12-8-26/h13,27-28H,1-12H2

InChI Key

NTFIXEKMMYPNIY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02236391

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

429.54

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.425

Distribution Coefficient, logD

3.396

Water Solubility, LogSw

-3.73

Polar Surface Area

77.956

Acid Dissociation Constant (pKa)

15.18

Base Dissociation Constant (pKb)

6.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.00

6583-0087 in Drug Discovery

Included in Screening Libraries

CNS targets activity set (6557 compounds)

Akt-Targeted Library (14764 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 6583-0087 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6583-0087?
Check Price and Availability of 6583-0087, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 6583-0087 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6583-0087
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6583-0087
  • 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 6583-0087 available by request