C782-1283 Screening compound: N-[2-(3,4-diethoxyphenyl)ethyl]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide

C782-1283 Screening compound: N-[2-(3,4-diethoxyphenyl)ethyl]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide
C782-1283 Screening compound: N-[2-(3,4-diethoxyphenyl)ethyl]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C782-1283
N-[2-(3,4-diethoxyphenyl)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

C782-1283

Molecular Formula

C27H35N3O3S (C27 H35 N3 O3 S)

Compound Name

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

IUPAC name

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

SMILES

CCOc(ccc(CCNC(C(CC1)CCN1c1nc(c(C)cc(C)c2)c2s1)=O)c1)c1OCC

InChI

InChI=1S/C27H35N3O3S/c1-5-32-22-8-7-20(17-23(22)33-6-2)9-12-28-26(31)21-10-13-30(14-11-21)27-29-25-19(4)15-18(3)16-24(25)34-27/h7-8,15-17,21H,5-6,9-14H2,1-4H3,(H,28,31)

InChI Key

XPOWQLMSJNVWPQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14794110

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

481.66

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.893

Distribution Coefficient, logD

4.892

Water Solubility, LogSw

-4.50

Polar Surface Area

52.672

Acid Dissociation Constant (pKa)

13.94

Base Dissociation Constant (pKb)

4.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

48.10

References: we are preparing a list of scientific research reports with C782-1283 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C782-1283?
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What is the minimum amount of C782-1283 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C782-1283
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C782-1283
  • 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 C782-1283 available by request