D305-1855 Screening compound: N-{1-butyl-2-[(pyrrolidin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}cyclohexanecarboxamide

D305-1855 Screening compound: N-{1-butyl-2-[(pyrrolidin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}cyclohexanecarboxamide
D305-1855 Screening compound: N-{1-butyl-2-[(pyrrolidin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}cyclohexanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D305-1855
N-{1-butyl-2-[(pyrrolidin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}cyclohexanecarboxamide

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

D305-1855

Molecular Formula

C23H34N4O (C23 H34 N4 O)

Compound Name

N-{1-butyl-2-[(pyrrolidin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}cyclohexanecarboxamide

IUPAC name

N-{1-butyl-2-[(pyrrolidin-1-yl)methyl]-1H-13-benzodiazol-5-yl}cyclohexanecarboxamide

SMILES

CCCCn1c(ccc(NC(C2CCCCC2)=O)c2)c2nc1CN1CCCC1

InChI

InChI=1S/C23H34N4O/c1-2-3-15-27-21-12-11-19(24-23(28)18-9-5-4-6-10-18)16-20(21)25-22(27)17-26-13-7-8-14-26/h11-12,16,18H,2-10,13-15,17H2,1H3,(H,24,28)

InChI Key

SWLKPZIYAFMADW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27580040

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.55

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

4.543

Distribution Coefficient, logD

3.597

Water Solubility, LogSw

-4.11

Polar Surface Area

38.775

Acid Dissociation Constant (pKa)

11.85

Base Dissociation Constant (pKb)

8.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

65.20

D305-1855 in Drug Discovery

Included in Screening Libraries

Protein Kinases Inhibitors Library (36801 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D305-1855 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D305-1855?
Check Price and Availability of D305-1855, 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 D305-1855 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D305-1855
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D305-1855
  • 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 D305-1855 available by request