2932-0394 Screening compound: 2',3',4,5-tetramethyl 5',5',7',9'-tetramethyl-6'-(2-phenylacetyl)-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate

2932-0394 Screening compound: 2',3',4,5-tetramethyl 5',5',7',9'-tetramethyl-6'-(2-phenylacetyl)-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
2932-0394 Screening compound: 2',3',4,5-tetramethyl 5',5',7',9'-tetramethyl-6'-(2-phenylacetyl)-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 2932-0394
2',3',4,5-tetramethyl 5',5',7',9'-tetramethyl-6'-(2-phenylacetyl)-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate

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

2932-0394

Molecular Formula

C34H33NO9S3 (C34 H33 NO9 S3)

Compound Name

2',3',4,5-tetramethyl 5',5',7',9'-tetramethyl-6'-(2-phenylacetyl)-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate

IUPAC name

2'3'45-tetramethyl 5'5'7'9'-tetramethyl-6'-(2-phenylacetyl)-5'6'-dihydrospiro[13-dithiole-21'-thiopyrano[23-c]quinoline]-2'3'45-tetracarboxylate

SMILES

CC1(C)N(C(Cc2ccccc2)=O)c(c(C)cc(C)c2)c2C(C23SC(C(OC)=O)=C(C(OC)=O)S2)=C1SC(C(OC)=O)=C3C(OC)=O

InChI

InChI=1S/C34H33NO9S3/c1-17-14-18(2)24-20(15-17)22-28(33(3,4)35(24)21(36)16-19-12-10-9-11-13-19)45-25(30(38)42-6)23(29(37)41-5)34(22)46-26(31(39)43-7)27(47-34)32(40)44-8/h9-15H,16H2,1-8H3

InChI Key

QDQFBKKUVIDHCH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01562051

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

695.84

Hydrogen Bond Acceptors Count

17.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

6.704

Distribution Coefficient, logD

6.704

Water Solubility, LogSw

-5.69

Polar Surface Area

99.680

Acid Dissociation Constant (pKa)

17.21

Base Dissociation Constant (pKb)

-2.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.40

References: we are preparing a list of scientific research reports with 2932-0394 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2932-0394?
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What is the minimum amount of 2932-0394 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2932-0394
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2932-0394
  • 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 2932-0394 available by request