D347-4138 Screening compound: 2-[2-(1-hydroxybutyl)-1H-1,3-benzodiazol-1-yl]-N-phenyl-N-(propan-2-yl)acetamide

D347-4138 Screening compound: 2-[2-(1-hydroxybutyl)-1H-1,3-benzodiazol-1-yl]-N-phenyl-N-(propan-2-yl)acetamide
D347-4138 Screening compound: 2-[2-(1-hydroxybutyl)-1H-1,3-benzodiazol-1-yl]-N-phenyl-N-(propan-2-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D347-4138
2-[2-(1-hydroxybutyl)-1H-1,3-benzodiazol-1-yl]-N-phenyl-N-(propan-2-yl)acetamide

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

D347-4138

Molecular Formula

C22H27N3O2 (C22 H27 N3 O2)

Compound Name

2-[2-(1-hydroxybutyl)-1H-1,3-benzodiazol-1-yl]-N-phenyl-N-(propan-2-yl)acetamide

IUPAC name

2-[2-(1-hydroxybutyl)-1H-13-benzodiazol-1-yl]-N-phenyl-N-(propan-2-yl)acetamide

SMILES

CCCC(c1nc(cccc2)c2n1CC(N(C(C)C)c1ccccc1)=O)O

InChI

InChI=1S/C22H27N3O2/c1-4-10-20(26)22-23-18-13-8-9-14-19(18)24(22)15-21(27)25(16(2)3)17-11-6-5-7-12-17/h5-9,11-14,16,20,26H,4,10,15H2,1-3H3/t20-/m0/s1

InChI Key

DCKMIFKPOMDPAL-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD10548654

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

365.48

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.082

Distribution Coefficient, logD

4.078

Water Solubility, LogSw

-3.94

Polar Surface Area

41.538

Acid Dissociation Constant (pKa)

14.81

Base Dissociation Constant (pKb)

5.40

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.40

D347-4138 in Drug Discovery

Included in Screening Libraries

PI3K-Targeted Library (17255 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

New Agro Library (44492 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases
Agro:
  • Agro
Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with D347-4138 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D347-4138?
Check Price and Availability of D347-4138, 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 D347-4138 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D347-4138
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D347-4138
  • 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 D347-4138 available by request