6583-0187 Screening compound: 1-amino-N~2~-(4-chlorophenyl)-8,8-dimethyl-5-morpholino-8,9-dihydro-6H-pyrano[4,3-d]thieno[2,3-b]pyridine-2-carboxamide

6583-0187 Screening compound: 1-amino-N~2~-(4-chlorophenyl)-8,8-dimethyl-5-morpholino-8,9-dihydro-6H-pyrano[4,3-d]thieno[2,3-b]pyridine-2-carboxamide
6583-0187 Screening compound: 1-amino-N~2~-(4-chlorophenyl)-8,8-dimethyl-5-morpholino-8,9-dihydro-6H-pyrano[4,3-d]thieno[2,3-b]pyridine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6583-0187
1-amino-N~2~-(4-chlorophenyl)-8,8-dimethyl-5-morpholino-8,9-dihydro-6H-pyrano[4,3-d]thieno[2,3-b]pyridine-2-carboxamide

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

6583-0187

Molecular Formula

C23H25ClN4O3S (C23 H25 ClN4 O3 S)

Compound Name

1-amino-N~2~-(4-chlorophenyl)-8,8-dimethyl-5-morpholino-8,9-dihydro-6H-pyrano[4,3-d]thieno[2,3-b]pyridine-2-carboxamide

IUPAC name

3-amino-N-(4-chlorophenyl)-1212-dimethyl-8-(morpholin-4-yl)-11-oxa-5-thia-7-azatricyclo[7.4.0.0^{26}]trideca-1(9)2(6)37-tetraene-4-carboxamide

SMILES

CC(C)(C1)OCc(c(N2CCOCC2)n2)c1c1c2sc(C(Nc(cc2)ccc2Cl)=O)c1N

InChI

InChI=1S/C23H25ClN4O3S/c1-23(2)11-15-16(12-31-23)20(28-7-9-30-10-8-28)27-22-17(15)18(25)19(32-22)21(29)26-14-5-3-13(24)4-6-14/h3-6H,7-12,25H2,1-2H3,(H,26,29)

InChI Key

SMQDVIHRIRIAST-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03285540

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.893

Distribution Coefficient, logD

4.893

Water Solubility, LogSw

-4.89

Polar Surface Area

71.348

Acid Dissociation Constant (pKa)

11.25

Base Dissociation Constant (pKb)

2.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

6583-0187 in Drug Discovery

Included in Screening Libraries

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 6583-0187 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6583-0187?
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What is the minimum amount of 6583-0187 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6583-0187
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6583-0187
  • 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 6583-0187 available by request