8640-0043 Screening compound: ethyl 2-({[3-(dimethylamino)propyl]carbamoyl}formamido)-5,5-dimethyl-4H,5H,7H-thieno[2,3-c]pyran-3-carboxylate

8640-0043 Screening compound: ethyl 2-({[3-(dimethylamino)propyl]carbamoyl}formamido)-5,5-dimethyl-4H,5H,7H-thieno[2,3-c]pyran-3-carboxylate
8640-0043 Screening compound: ethyl 2-({[3-(dimethylamino)propyl]carbamoyl}formamido)-5,5-dimethyl-4H,5H,7H-thieno[2,3-c]pyran-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8640-0043
ethyl 2-({[3-(dimethylamino)propyl]carbamoyl}formamido)-5,5-dimethyl-4H,5H,7H-thieno[2,3-c]pyran-3-carboxylate

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

8640-0043

Molecular Formula

C19H29N3O5S (C19 H29 N3 O5 S)

Compound Name

ethyl 2-({[3-(dimethylamino)propyl]carbamoyl}formamido)-5,5-dimethyl-4H,5H,7H-thieno[2,3-c]pyran-3-carboxylate

IUPAC name

ethyl 2-({[3-(dimethylamino)propyl]carbamoyl}formamido)-55-dimethyl-4H5H7H-thieno[23-c]pyran-3-carboxylate

SMILES

CCOC(c1c(NC(C(NCCCN(C)C)=O)=O)sc2c1CC(C)(C)OC2)=O

InChI

InChI=1S/C19H29N3O5S/c1-6-26-18(25)14-12-10-19(2,3)27-11-13(12)28-17(14)21-16(24)15(23)20-8-7-9-22(4)5/h6-11H2,1-5H3,(H,20,23)(H,21,24)

InChI Key

ARSWEBKHHYLZQJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14713529

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

411.52

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.489

Distribution Coefficient, logD

1.489

Water Solubility, LogSw

-1.97

Polar Surface Area

80.159

Acid Dissociation Constant (pKa)

0.55

Base Dissociation Constant (pKb)

9.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

63.20

8640-0043 in Drug Discovery

Included in Screening Libraries

Autophagy-Targeted Library (4564 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 8640-0043 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8640-0043?
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What is the minimum amount of 8640-0043 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8640-0043
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8640-0043
  • 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 8640-0043 available by request