1900-2940 Screening compound: ethyl (2Z)-5-[4-(acetyloxy)phenyl]-2-[(1,3-diphenyl-1H-pyrazol-4-yl)methylidene]-7-methyl-3-oxo-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

1900-2940 Screening compound: ethyl (2Z)-5-[4-(acetyloxy)phenyl]-2-[(1,3-diphenyl-1H-pyrazol-4-yl)methylidene]-7-methyl-3-oxo-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
1900-2940 Screening compound: ethyl (2Z)-5-[4-(acetyloxy)phenyl]-2-[(1,3-diphenyl-1H-pyrazol-4-yl)methylidene]-7-methyl-3-oxo-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1900-2940
ethyl (2Z)-5-[4-(acetyloxy)phenyl]-2-[(1,3-diphenyl-1H-pyrazol-4-yl)methylidene]-7-methyl-3-oxo-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-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

1900-2940

Molecular Formula

C34H28N4O5S (C34 H28 N4 O5 S)

Compound Name

ethyl (2Z)-5-[4-(acetyloxy)phenyl]-2-[(1,3-diphenyl-1H-pyrazol-4-yl)methylidene]-7-methyl-3-oxo-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

IUPAC name

ethyl (2Z)-5-[4-(acetyloxy)phenyl]-2-[(13-diphenyl-1H-pyrazol-4-yl)methylidene]-7-methyl-3-oxo-2H3H5H-[13]thiazolo[32-a]pyrimidine-6-carboxylate

SMILES

CCOC(C(C(c(cc1)ccc1OC(C)=O)N1C2=O)=C(C)N=C1S/C2=C\c1cn(-c2ccccc2)nc1-c1ccccc1)=O

InChI

InChI=1S/C34H28N4O5S/c1-4-42-33(41)29-21(2)35-34-38(31(29)24-15-17-27(18-16-24)43-22(3)39)32(40)28(44-34)19-25-20-37(26-13-9-6-10-14-26)36-30(25)23-11-7-5-8-12-23/h5-20,31H,4H2,1-3H3/t31-/m1/s1

InChI Key

VXZDVZZUUMHTCB-WJOKGBTCSA-N

MDL Number (MFCD)

MFCD01072595

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

604.69

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

5.453

Distribution Coefficient, logD

5.453

Water Solubility, LogSw

-5.43

Polar Surface Area

81.131

Acid Dissociation Constant (pKa)

22.67

Base Dissociation Constant (pKb)

2.54

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

14.70

1900-2940 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1900-2940 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1900-2940?
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What is the minimum amount of 1900-2940 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1900-2940
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1900-2940
  • 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 1900-2940 available by request