1187-0538 Screening compound: 8-[(dimethylamino)methyl]-6-ethyl-7-hydroxy-3-(1,3-thiazol-4-yl)-4H-chromen-4-one

1187-0538 Screening compound: 8-[(dimethylamino)methyl]-6-ethyl-7-hydroxy-3-(1,3-thiazol-4-yl)-4H-chromen-4-one
1187-0538 Screening compound: 8-[(dimethylamino)methyl]-6-ethyl-7-hydroxy-3-(1,3-thiazol-4-yl)-4H-chromen-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 1187-0538
8-[(dimethylamino)methyl]-6-ethyl-7-hydroxy-3-(1,3-thiazol-4-yl)-4H-chromen-4-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

1187-0538

Molecular Formula

C17H18N2O3S (C17 H18 N2 O3 S)

Compound Name

8-[(dimethylamino)methyl]-6-ethyl-7-hydroxy-3-(1,3-thiazol-4-yl)-4H-chromen-4-one

IUPAC name

8-[(dimethylamino)methyl]-6-ethyl-7-hydroxy-3-(13-thiazol-4-yl)-4H-chromen-4-one

SMILES

CCc(c(O)c1CN(C)C)cc2c1OC=C(c1cscn1)C2=O

InChI

InChI=1S/C17H18N2O3S/c1-4-10-5-11-16(21)13(14-8-23-9-18-14)7-22-17(11)12(15(10)20)6-19(2)3/h5,7-9,20H,4,6H2,1-3H3

InChI Key

VOSFZMWFMWDBLW-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

330.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.704

Distribution Coefficient, logD

1.655

Water Solubility, LogSw

-2.93

Polar Surface Area

49.539

Acid Dissociation Constant (pKa)

8.33

Base Dissociation Constant (pKb)

9.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.41

References: we are preparing a list of scientific research reports with 1187-0538 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1187-0538?
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What is the minimum amount of 1187-0538 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1187-0538
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1187-0538
  • 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 1187-0538 available by request