D332-0059 Screening compound: N-{2-[(azepan-1-yl)methyl]-1-methyl-1H-1,3-benzodiazol-5-yl}-3,4-dimethoxybenzamide

D332-0059 Screening compound: N-{2-[(azepan-1-yl)methyl]-1-methyl-1H-1,3-benzodiazol-5-yl}-3,4-dimethoxybenzamide
D332-0059 Screening compound: N-{2-[(azepan-1-yl)methyl]-1-methyl-1H-1,3-benzodiazol-5-yl}-3,4-dimethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D332-0059
N-{2-[(azepan-1-yl)methyl]-1-methyl-1H-1,3-benzodiazol-5-yl}-3,4-dimethoxybenzamide

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

D332-0059

Molecular Formula

C24H30N4O3 (C24 H30 N4 O3)

Compound Name

N-{2-[(azepan-1-yl)methyl]-1-methyl-1H-1,3-benzodiazol-5-yl}-3,4-dimethoxybenzamide

IUPAC name

N-{2-[(azepan-1-yl)methyl]-1-methyl-1H-13-benzodiazol-5-yl}-34-dimethoxybenzamide

SMILES

Cn1c(ccc(NC(c(cc2)cc(OC)c2OC)=O)c2)c2nc1CN1CCCCCC1

InChI

InChI=1S/C24H30N4O3/c1-27-20-10-9-18(25-24(29)17-8-11-21(30-2)22(14-17)31-3)15-19(20)26-23(27)16-28-12-6-4-5-7-13-28/h8-11,14-15H,4-7,12-13,16H2,1-3H3,(H,25,29)

InChI Key

FIOKCOBZRAUQIX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09222795

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.53

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.424

Distribution Coefficient, logD

3.195

Water Solubility, LogSw

-3.65

Polar Surface Area

54.640

Acid Dissociation Constant (pKa)

11.89

Base Dissociation Constant (pKb)

7.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.70

References: we are preparing a list of scientific research reports with D332-0059 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D332-0059?
Check Price and Availability of D332-0059, 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 D332-0059 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D332-0059
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D332-0059
  • 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 D332-0059 available by request