Y032-4654 Screening compound: N,N-dimethyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]tetrahydro-1,4(2H)-pyridinedicarboxamide

Y032-4654 Screening compound: N,N-dimethyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]tetrahydro-1,4(2H)-pyridinedicarboxamide
Y032-4654 Screening compound: N,N-dimethyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]tetrahydro-1,4(2H)-pyridinedicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y032-4654
N,N-dimethyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]tetrahydro-1,4(2H)-pyridinedicarboxamide

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

Y032-4654

Molecular Formula

C23H26N4O2S (C23 H26 N4 O2 S)

Compound Name

N,N-dimethyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]tetrahydro-1,4(2H)-pyridinedicarboxamide

IUPAC name

N1N1-dimethyl-N4-[4-(6-methyl-13-benzothiazol-2-yl)phenyl]piperidine-14-dicarboxamide

SMILES

Cc(cc1)cc2c1nc(-c(cc1)ccc1NC(C(CC1)CCN1C(N(C)C)=O)=O)s2

InChI

InChI=1S/C23H26N4O2S/c1-15-4-9-19-20(14-15)30-22(25-19)17-5-7-18(8-6-17)24-21(28)16-10-12-27(13-11-16)23(29)26(2)3/h4-9,14,16H,10-13H2,1-3H3,(H,24,28)

InChI Key

DDTUNSFMHCYCIS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15180633

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.55

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.930

Distribution Coefficient, logD

3.930

Water Solubility, LogSw

-3.87

Polar Surface Area

50.585

Acid Dissociation Constant (pKa)

12.51

Base Dissociation Constant (pKb)

2.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.78

References: we are preparing a list of scientific research reports with Y032-4654 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y032-4654?
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What is the minimum amount of Y032-4654 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y032-4654
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y032-4654
  • 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 Y032-4654 available by request