C276-0649 Screening compound: hexyl 3-methyl-4-oxo-6-(3,4,5-trimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate

C276-0649 Screening compound: hexyl 3-methyl-4-oxo-6-(3,4,5-trimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
C276-0649 Screening compound: hexyl 3-methyl-4-oxo-6-(3,4,5-trimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C276-0649
hexyl 3-methyl-4-oxo-6-(3,4,5-trimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indole-2-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

C276-0649

Molecular Formula

C25H33NO6 (C25 H33 NO6)

Compound Name

hexyl 3-methyl-4-oxo-6-(3,4,5-trimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate

IUPAC name

hexyl 3-methyl-4-oxo-6-(345-trimethoxyphenyl)-4567-tetrahydro-1H-indole-2-carboxylate

SMILES

CCCCCCOC(c1c(C)c(C(CC(C2)c(cc3OC)cc(OC)c3OC)=O)c2[nH]1)=O

InChI

InChI=1S/C25H33NO6/c1-6-7-8-9-10-32-25(28)23-15(2)22-18(26-23)11-16(12-19(22)27)17-13-20(29-3)24(31-5)21(14-17)30-4/h13-14,16,26H,6-12H2,1-5H3/t16-/m1/s1

InChI Key

DBZFRLCTAJCUPP-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD06754373

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.54

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.082

Distribution Coefficient, logD

5.082

Water Solubility, LogSw

-4.90

Polar Surface Area

69.066

Acid Dissociation Constant (pKa)

12.73

Base Dissociation Constant (pKb)

-4.13

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

52.00

References: we are preparing a list of scientific research reports with C276-0649 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C276-0649?
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What is the minimum amount of C276-0649 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C276-0649
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C276-0649
  • 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 C276-0649 available by request