C782-1107 Screening compound: 2-[4-(4-benzylpiperazine-1-carbonyl)piperidin-1-yl]-4,6-dimethyl-1,3-benzothiazole

C782-1107 Screening compound: 2-[4-(4-benzylpiperazine-1-carbonyl)piperidin-1-yl]-4,6-dimethyl-1,3-benzothiazole
C782-1107 Screening compound: 2-[4-(4-benzylpiperazine-1-carbonyl)piperidin-1-yl]-4,6-dimethyl-1,3-benzothiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound C782-1107
2-[4-(4-benzylpiperazine-1-carbonyl)piperidin-1-yl]-4,6-dimethyl-1,3-benzothiazole

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

C782-1107

Molecular Formula

C26H32N4OS (C26 H32 N4 OS)

Compound Name

2-[4-(4-benzylpiperazine-1-carbonyl)piperidin-1-yl]-4,6-dimethyl-1,3-benzothiazole

IUPAC name

2-[4-(4-benzylpiperazine-1-carbonyl)piperidin-1-yl]-46-dimethyl-13-benzothiazole

SMILES

Cc(cc1C)cc2c1nc(N(CC1)CCC1C(N1CCN(Cc3ccccc3)CC1)=O)s2

InChI

InChI=1S/C26H32N4OS/c1-19-16-20(2)24-23(17-19)32-26(27-24)30-10-8-22(9-11-30)25(31)29-14-12-28(13-15-29)18-21-6-4-3-5-7-21/h3-7,16-17,22H,8-15,18H2,1-2H3

InChI Key

AJHMDAUJOVNGLR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14794044

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

448.63

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.941

Distribution Coefficient, logD

4.889

Water Solubility, LogSw

-4.56

Polar Surface Area

34.185

Acid Dissociation Constant (pKa)

21.91

Base Dissociation Constant (pKb)

6.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.20

C782-1107 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with C782-1107 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C782-1107?
Check Price and Availability of C782-1107, 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 C782-1107 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C782-1107
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C782-1107
  • 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 C782-1107 available by request