C202-3211 Screening compound: 7-(3,4-dimethoxyphenyl)-3-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1,2,5,6,7,8-hexahydroquinoline-2,5-dione

C202-3211 Screening compound: 7-(3,4-dimethoxyphenyl)-3-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1,2,5,6,7,8-hexahydroquinoline-2,5-dione
C202-3211 Screening compound: 7-(3,4-dimethoxyphenyl)-3-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1,2,5,6,7,8-hexahydroquinoline-2,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound C202-3211
7-(3,4-dimethoxyphenyl)-3-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1,2,5,6,7,8-hexahydroquinoline-2,5-dione

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

C202-3211

Molecular Formula

C27H24N2O4S (C27 H24 N2 O4 S)

Compound Name

7-(3,4-dimethoxyphenyl)-3-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1,2,5,6,7,8-hexahydroquinoline-2,5-dione

IUPAC name

7-(34-dimethoxyphenyl)-3-[4-(4-methylphenyl)-13-thiazol-2-yl]-125678-hexahydroquinoline-25-dione

SMILES

Cc(cc1)ccc1-c1csc(C2=CC(C(CC(C3)c(cc4)cc(OC)c4OC)=O)=C3NC2=O)n1

InChI

InChI=1S/C27H24N2O4S/c1-15-4-6-16(7-5-15)22-14-34-27(29-22)20-13-19-21(28-26(20)31)10-18(11-23(19)30)17-8-9-24(32-2)25(12-17)33-3/h4-9,12-14,18H,10-11H2,1-3H3,(H,28,31)/t18-/m0/s1

InChI Key

UKFZUZMOTDBPCX-SFHVURJKSA-N

MDL Number (MFCD)

MFCD14731539

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

472.56

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.277

Distribution Coefficient, logD

4.335

Water Solubility, LogSw

-5.21

Polar Surface Area

62.786

Acid Dissociation Constant (pKa)

6.51

Base Dissociation Constant (pKb)

-4.28

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.20

C202-3211 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C202-3211 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C202-3211?
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What is the minimum amount of C202-3211 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C202-3211
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C202-3211
  • 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 C202-3211 available by request