D631-0376 Screening compound: 1-[4-(1H-1,3-benzodiazol-2-yl)piperidin-1-yl]-3-phenylpropan-1-one

D631-0376 Screening compound: 1-[4-(1H-1,3-benzodiazol-2-yl)piperidin-1-yl]-3-phenylpropan-1-one
D631-0376 Screening compound: 1-[4-(1H-1,3-benzodiazol-2-yl)piperidin-1-yl]-3-phenylpropan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D631-0376
1-[4-(1H-1,3-benzodiazol-2-yl)piperidin-1-yl]-3-phenylpropan-1-one

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

D631-0376

Molecular Formula

C21H23N3O (C21 H23 N3 O)

Compound Name

1-[4-(1H-1,3-benzodiazol-2-yl)piperidin-1-yl]-3-phenylpropan-1-one

IUPAC name

1-[4-(1H-13-benzodiazol-2-yl)piperidin-1-yl]-3-phenylpropan-1-one

SMILES

O=C(CCc1ccccc1)N(CC1)CCC1c1nc(cccc2)c2[nH]1

InChI

InChI=1S/C21H23N3O/c25-20(11-10-16-6-2-1-3-7-16)24-14-12-17(13-15-24)21-22-18-8-4-5-9-19(18)23-21/h1-9,17H,10-15H2,(H,22,23)

InChI Key

CSJIBMADZQUWCB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD17875485

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

333.43

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.492

Distribution Coefficient, logD

3.485

Water Solubility, LogSw

-3.51

Polar Surface Area

35.379

Acid Dissociation Constant (pKa)

13.09

Base Dissociation Constant (pKb)

5.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

D631-0376 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D631-0376 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D631-0376?
Check Price and Availability of D631-0376, 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 D631-0376 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D631-0376
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D631-0376
  • 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 D631-0376 available by request