8015-3094 Screening compound: 5-[3-methoxy-4-(prop-2-en-1-yloxy)phenyl]-3-methyl-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-7-one

8015-3094 Screening compound: 5-[3-methoxy-4-(prop-2-en-1-yloxy)phenyl]-3-methyl-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-7-one
8015-3094 Screening compound: 5-[3-methoxy-4-(prop-2-en-1-yloxy)phenyl]-3-methyl-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-7-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8015-3094
5-[3-methoxy-4-(prop-2-en-1-yloxy)phenyl]-3-methyl-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-7-one

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

8015-3094

Molecular Formula

C16H15N3O3S2 (C16 H15 N3 O3 S2)

Compound Name

5-[3-methoxy-4-(prop-2-en-1-yloxy)phenyl]-3-methyl-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-7-one

IUPAC name

5-[3-methoxy-4-(prop-2-en-1-yloxy)phenyl]-3-methyl-2-sulfanylidene-2H3H6H7H-[13]thiazolo[45-d]pyrimidin-7-one

SMILES

CN(C(N=C(c(cc1)cc(OC)c1OCC=C)NC1=O)=C1S1)C1=S

InChI

InChI=1S/C16H15N3O3S2/c1-4-7-22-10-6-5-9(8-11(10)21-3)13-17-14-12(15(20)18-13)24-16(23)19(14)2/h4-6,8H,1,7H2,2-3H3,(H,17,18,20)

InChI Key

PUSOTMZLIXZWPT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04060557

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.45

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.402

Distribution Coefficient, logD

2.402

Water Solubility, LogSw

-3.07

Polar Surface Area

52.470

Acid Dissociation Constant (pKa)

10.77

Base Dissociation Constant (pKb)

2.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

8015-3094 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • 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 8015-3094 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8015-3094?
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What is the minimum amount of 8015-3094 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8015-3094
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8015-3094
  • 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 8015-3094 available by request