C909-0338 Screening compound: N~2~-(4-chloro-2-methoxy-5-methylphenyl)-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c]thiochromene-2-carboxamide

C909-0338 Screening compound: N~2~-(4-chloro-2-methoxy-5-methylphenyl)-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c]thiochromene-2-carboxamide
C909-0338 Screening compound: N~2~-(4-chloro-2-methoxy-5-methylphenyl)-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c]thiochromene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C909-0338
N~2~-(4-chloro-2-methoxy-5-methylphenyl)-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c]thiochromene-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

C909-0338

Molecular Formula

C20H16ClNO4S2 (C20 H16 ClNO4 S2)

Compound Name

N~2~-(4-chloro-2-methoxy-5-methylphenyl)-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c]thiochromene-2-carboxamide

IUPAC name

N-(4-chloro-2-methoxy-5-methylphenyl)-55-dioxo-4H-5lambda6-thieno[32-c]thiochromene-2-carboxamide

SMILES

Cc(cc(c(OC)c1)NC(c2cc(CS(c3c-4cccc3)(=O)=O)c4s2)=O)c1Cl

InChI

InChI=1S/C20H16ClNO4S2/c1-11-7-15(16(26-2)9-14(11)21)22-20(23)17-8-12-10-28(24,25)18-6-4-3-5-13(18)19(12)27-17/h3-9H,10H2,1-2H3,(H,22,23)

InChI Key

HFAFPERJYJONNA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14808095

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

433.94

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.038

Distribution Coefficient, logD

5.037

Water Solubility, LogSw

-5.13

Polar Surface Area

59.455

Acid Dissociation Constant (pKa)

9.80

Base Dissociation Constant (pKb)

-1.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

References: we are preparing a list of scientific research reports with C909-0338 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C909-0338?
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What is the minimum amount of C909-0338 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C909-0338
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C909-0338
  • 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 C909-0338 available by request