2388-1179 Screening compound: methyl 5-(4-methoxyphenyl)-7-methyl-3-oxo-2-[(3Z)-2-oxo-1-(prop-2-en-1-yl)-2,3-dihydro-1H-indol-3-ylidene]-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

2388-1179 Screening compound: methyl 5-(4-methoxyphenyl)-7-methyl-3-oxo-2-[(3Z)-2-oxo-1-(prop-2-en-1-yl)-2,3-dihydro-1H-indol-3-ylidene]-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
2388-1179 Screening compound: methyl 5-(4-methoxyphenyl)-7-methyl-3-oxo-2-[(3Z)-2-oxo-1-(prop-2-en-1-yl)-2,3-dihydro-1H-indol-3-ylidene]-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 2388-1179
methyl 5-(4-methoxyphenyl)-7-methyl-3-oxo-2-[(3Z)-2-oxo-1-(prop-2-en-1-yl)-2,3-dihydro-1H-indol-3-ylidene]-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

2388-1179

Molecular Formula

C27H23N3O5S (C27 H23 N3 O5 S)

Compound Name

methyl 5-(4-methoxyphenyl)-7-methyl-3-oxo-2-[(3Z)-2-oxo-1-(prop-2-en-1-yl)-2,3-dihydro-1H-indol-3-ylidene]-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

IUPAC name

methyl 5-(4-methoxyphenyl)-7-methyl-3-oxo-2-[(3Z)-2-oxo-1-(prop-2-en-1-yl)-23-dihydro-1H-indol-3-ylidene]-2H3H5H-[13]thiazolo[32-a]pyrimidine-6-carboxylate

SMILES

CC(N=C(N(C1c(cc2)ccc2OC)C2=O)S/C2=C(/c(cccc2)c2N2CC=C)\C2=O)=C1C(OC)=O

InChI

InChI=1S/C27H23N3O5S/c1-5-14-29-19-9-7-6-8-18(19)21(24(29)31)23-25(32)30-22(16-10-12-17(34-3)13-11-16)20(26(33)35-4)15(2)28-27(30)36-23/h5-13,22H,1,14H2,2-4H3/t22-/m1/s1

InChI Key

UFRCBMHODYHPOI-JOCHJYFZSA-N

MDL Number (MFCD)

MFCD01072757

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

501.56

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.733

Distribution Coefficient, logD

3.733

Water Solubility, LogSw

-4.11

Polar Surface Area

69.430

Acid Dissociation Constant (pKa)

27.35

Base Dissociation Constant (pKb)

1.04

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

18.50

References: we are preparing a list of scientific research reports with 2388-1179 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2388-1179?
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What is the minimum amount of 2388-1179 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2388-1179
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2388-1179
  • 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 2388-1179 available by request