C782-1175 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide

C782-1175 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide
C782-1175 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C782-1175
N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide

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

C782-1175

Molecular Formula

C25H31N3O3S (C25 H31 N3 O3 S)

Compound Name

N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide

IUPAC name

N-[2-(34-dimethoxyphenyl)ethyl]-1-(46-dimethyl-13-benzothiazol-2-yl)piperidine-4-carboxamide

SMILES

Cc(cc1C)cc2c1nc(N(CC1)CCC1C(NCCc(cc1)cc(OC)c1OC)=O)s2

InChI

InChI=1S/C25H31N3O3S/c1-16-13-17(2)23-22(14-16)32-25(27-23)28-11-8-19(9-12-28)24(29)26-10-7-18-5-6-20(30-3)21(15-18)31-4/h5-6,13-15,19H,7-12H2,1-4H3,(H,26,29)

InChI Key

OTAKQFVMIQJAKP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14794064

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

453.61

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.402

Distribution Coefficient, logD

4.401

Water Solubility, LogSw

-4.25

Polar Surface Area

53.512

Acid Dissociation Constant (pKa)

13.94

Base Dissociation Constant (pKb)

4.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.00

References: we are preparing a list of scientific research reports with C782-1175 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C782-1175?
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What is the minimum amount of C782-1175 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C782-1175
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C782-1175
  • 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 C782-1175 available by request