D016-1210 Screening compound: 1-[5-(3-{[(4-chlorophenyl)methyl]amino}-2-hydroxypropoxy)-2-methyl-1-(4-methylphenyl)-1H-indol-3-yl]ethan-1-one

D016-1210 Screening compound: 1-[5-(3-{[(4-chlorophenyl)methyl]amino}-2-hydroxypropoxy)-2-methyl-1-(4-methylphenyl)-1H-indol-3-yl]ethan-1-one
D016-1210 Screening compound: 1-[5-(3-{[(4-chlorophenyl)methyl]amino}-2-hydroxypropoxy)-2-methyl-1-(4-methylphenyl)-1H-indol-3-yl]ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D016-1210
1-[5-(3-{[(4-chlorophenyl)methyl]amino}-2-hydroxypropoxy)-2-methyl-1-(4-methylphenyl)-1H-indol-3-yl]ethan-1-one

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

D016-1210

Molecular Formula

C28H29ClN2O3 (C28 H29 ClN2 O3)

Compound Name

1-[5-(3-{[(4-chlorophenyl)methyl]amino}-2-hydroxypropoxy)-2-methyl-1-(4-methylphenyl)-1H-indol-3-yl]ethan-1-one

IUPAC name

1-[5-(3-{[(4-chlorophenyl)methyl]amino}-2-hydroxypropoxy)-2-methyl-1-(4-methylphenyl)-1H-indol-3-yl]ethan-1-one

SMILES

CC(c(c1c2ccc(OCC(CNCc(cc3)ccc3Cl)O)c1)c(C)n2-c1ccc(C)cc1)=O

InChI

InChI=1S/C28H29ClN2O3/c1-18-4-10-23(11-5-18)31-19(2)28(20(3)32)26-14-25(12-13-27(26)31)34-17-24(33)16-30-15-21-6-8-22(29)9-7-21/h4-14,24,30,33H,15-17H2,1-3H3/t24-/m0/s1

InChI Key

RVFUPXKGQCCPLY-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD14810871

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

477

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.368

Distribution Coefficient, logD

4.746

Water Solubility, LogSw

-5.86

Polar Surface Area

51.893

Acid Dissociation Constant (pKa)

16.37

Base Dissociation Constant (pKb)

7.90

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with D016-1210 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D016-1210?
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What is the minimum amount of D016-1210 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D016-1210
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D016-1210
  • 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 D016-1210 available by request