E644-0575 Screening compound: [4-(2,5-dimethyl-4,5,6,7-tetrahydro-1H-indol-1-yl)phenyl](4-phenylpiperazino)methanone

E644-0575 Screening compound: [4-(2,5-dimethyl-4,5,6,7-tetrahydro-1H-indol-1-yl)phenyl](4-phenylpiperazino)methanone
E644-0575 Screening compound: [4-(2,5-dimethyl-4,5,6,7-tetrahydro-1H-indol-1-yl)phenyl](4-phenylpiperazino)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound E644-0575
[4-(2,5-dimethyl-4,5,6,7-tetrahydro-1H-indol-1-yl)phenyl](4-phenylpiperazino)methanone

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

E644-0575

Molecular Formula

C27H31N3O (C27 H31 N3 O)

Compound Name

[4-(2,5-dimethyl-4,5,6,7-tetrahydro-1H-indol-1-yl)phenyl](4-phenylpiperazino)methanone

IUPAC name

n/a

SMILES

CC(CC1)Cc(cc2C)c1n2-c(cc1)ccc1C(N(CC1)CCN1c1ccccc1)=O

InChI

InChI=1S/C27H31N3O/c1-20-8-13-26-23(18-20)19-21(2)30(26)25-11-9-22(10-12-25)27(31)29-16-14-28(15-17-29)24-6-4-3-5-7-24/h3-7,9-12,19-20H,8,13-18H2,1-2H3/t20-/m1/s1

InChI Key

OAHSMGUXKDUWDK-HXUWFJFHSA-N

MDL Number (MFCD)

MFCD14907366

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.56

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.771

Distribution Coefficient, logD

4.771

Water Solubility, LogSw

-4.59

Polar Surface Area

22.717

Acid Dissociation Constant (pKa)

23.75

Base Dissociation Constant (pKb)

5.75

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.00

References: we are preparing a list of scientific research reports with E644-0575 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E644-0575?
Check Price and Availability of E644-0575, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of E644-0575 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E644-0575
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E644-0575
  • 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 E644-0575 available by request