8006-8592 Screening compound: 3'-benzyl 5'-methyl 6'-amino-2'-methyl-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3',5'-dicarboxylate

8006-8592 Screening compound: 3'-benzyl 5'-methyl 6'-amino-2'-methyl-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3',5'-dicarboxylate
8006-8592 Screening compound: 3'-benzyl 5'-methyl 6'-amino-2'-methyl-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3',5'-dicarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8006-8592
3'-benzyl 5'-methyl 6'-amino-2'-methyl-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3',5'-dicarboxylate

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

8006-8592

Molecular Formula

C23H20N2O6 (C23 H20 N2 O6)

Compound Name

3'-benzyl 5'-methyl 6'-amino-2'-methyl-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3',5'-dicarboxylate

IUPAC name

3'-benzyl 5'-methyl 6'-amino-2'-methyl-2-oxo-12-dihydrospiro[indole-34'-pyran]-3'5'-dicarboxylate

SMILES

CC(OC(N)=C(C1(c(cccc2)c2N2)C2=O)C(OC)=O)=C1C(OCc1ccccc1)=O

InChI

InChI=1S/C23H20N2O6/c1-13-17(21(27)30-12-14-8-4-3-5-9-14)23(18(19(24)31-13)20(26)29-2)15-10-6-7-11-16(15)25-22(23)28/h3-11H,12,24H2,1-2H3,(H,25,28)/t23-/m0/s1

InChI Key

SRGFSEUHBIYBLB-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD00827067

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.42

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.775

Distribution Coefficient, logD

2.775

Water Solubility, LogSw

-3.56

Polar Surface Area

96.911

Acid Dissociation Constant (pKa)

11.76

Base Dissociation Constant (pKb)

1.46

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

17.39

References: we are preparing a list of scientific research reports with 8006-8592 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8006-8592?
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What is the minimum amount of 8006-8592 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8006-8592
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8006-8592
  • 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 8006-8592 available by request