C276-0236 Screening compound: heptyl 3-methyl-4-oxo-6-phenyl-4,5,6,7-tetrahydro-1H-indole-2-carboxylate

C276-0236 Screening compound: heptyl 3-methyl-4-oxo-6-phenyl-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
C276-0236 Screening compound: heptyl 3-methyl-4-oxo-6-phenyl-4,5,6,7-tetrahydro-1H-indole-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C276-0236
heptyl 3-methyl-4-oxo-6-phenyl-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

C276-0236

Molecular Formula

C23H29NO3 (C23 H29 NO3)

Compound Name

heptyl 3-methyl-4-oxo-6-phenyl-4,5,6,7-tetrahydro-1H-indole-2-carboxylate

IUPAC name

heptyl 3-methyl-4-oxo-6-phenyl-4567-tetrahydro-1H-indole-2-carboxylate

SMILES

CCCCCCCOC(c1c(C)c(C(CC(C2)c3ccccc3)=O)c2[nH]1)=O

InChI

InChI=1S/C23H29NO3/c1-3-4-5-6-10-13-27-23(26)22-16(2)21-19(24-22)14-18(15-20(21)25)17-11-8-7-9-12-17/h7-9,11-12,18,24H,3-6,10,13-15H2,1-2H3/t18-/m1/s1

InChI Key

PSXREHVUYXXTHR-GOSISDBHSA-N

MDL Number (MFCD)

MFCD06651869

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.49

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.043

Distribution Coefficient, logD

6.043

Water Solubility, LogSw

-5.46

Polar Surface Area

46.089

Acid Dissociation Constant (pKa)

12.73

Base Dissociation Constant (pKb)

-4.13

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

47.80

References: we are preparing a list of scientific research reports with C276-0236 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C276-0236?
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What is the minimum amount of C276-0236 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C276-0236
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C276-0236
  • 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 C276-0236 available by request