D305-1815 Screening compound: 2-methyl-N-[1-(propan-2-yl)-2-[(pyrrolidin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl]propanamide

D305-1815 Screening compound: 2-methyl-N-[1-(propan-2-yl)-2-[(pyrrolidin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl]propanamide
D305-1815 Screening compound: 2-methyl-N-[1-(propan-2-yl)-2-[(pyrrolidin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D305-1815
2-methyl-N-[1-(propan-2-yl)-2-[(pyrrolidin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl]propanamide

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

D305-1815

Molecular Formula

C19H28N4O (C19 H28 N4 O)

Compound Name

2-methyl-N-[1-(propan-2-yl)-2-[(pyrrolidin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl]propanamide

IUPAC name

2-methyl-N-[1-(propan-2-yl)-2-[(pyrrolidin-1-yl)methyl]-1H-13-benzodiazol-5-yl]propanamide

SMILES

CC(C)C(Nc(cc1)cc2c1n(C(C)C)c(CN1CCCC1)n2)=O

InChI

InChI=1S/C19H28N4O/c1-13(2)19(24)20-15-7-8-17-16(11-15)21-18(23(17)14(3)4)12-22-9-5-6-10-22/h7-8,11,13-14H,5-6,9-10,12H2,1-4H3,(H,20,24)

InChI Key

WHTHJJJRQSHYHN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27580020

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

328.46

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.155

Distribution Coefficient, logD

2.829

Water Solubility, LogSw

-3.20

Polar Surface Area

39.952

Acid Dissociation Constant (pKa)

12.24

Base Dissociation Constant (pKb)

7.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.90

D305-1815 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS MPO Library (28609 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Protein-Protein Interaction Library (218420 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Mimetics
  • Mimetics
Therapeutical areas:
  • Nervous system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D305-1815 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D305-1815?
Check Price and Availability of D305-1815, 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 D305-1815 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D305-1815
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D305-1815
  • 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 D305-1815 available by request