D277-1472 Screening compound: N-methyl-N-{[1-(3-phenylpropyl)-1H-1,3-benzodiazol-2-yl]methyl}acetamide

D277-1472 Screening compound: N-methyl-N-{[1-(3-phenylpropyl)-1H-1,3-benzodiazol-2-yl]methyl}acetamide
D277-1472 Screening compound: N-methyl-N-{[1-(3-phenylpropyl)-1H-1,3-benzodiazol-2-yl]methyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D277-1472
N-methyl-N-{[1-(3-phenylpropyl)-1H-1,3-benzodiazol-2-yl]methyl}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

D277-1472

Molecular Formula

C20H23N3O (C20 H23 N3 O)

Compound Name

N-methyl-N-{[1-(3-phenylpropyl)-1H-1,3-benzodiazol-2-yl]methyl}acetamide

IUPAC name

N-methyl-N-{[1-(3-phenylpropyl)-1H-13-benzodiazol-2-yl]methyl}acetamide

SMILES

CC(N(C)Cc1nc(cccc2)c2n1CCCc1ccccc1)=O

InChI

InChI=1S/C20H23N3O/c1-16(24)22(2)15-20-21-18-12-6-7-13-19(18)23(20)14-8-11-17-9-4-3-5-10-17/h3-7,9-10,12-13H,8,11,14-15H2,1-2H3

InChI Key

HUAXGXYBCBDHGA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08362126

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

321.42

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.504

Distribution Coefficient, logD

3.504

Water Solubility, LogSw

-3.56

Polar Surface Area

28.012

Acid Dissociation Constant (pKa)

22.50

Base Dissociation Constant (pKb)

2.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

D277-1472 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Cardiovascular

References: we are preparing a list of scientific research reports with D277-1472 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D277-1472?
Check Price and Availability of D277-1472, 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 D277-1472 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D277-1472
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D277-1472
  • 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 D277-1472 available by request