D277-1496 Screening compound: N-butyl-N-methyl-2-{2-[(N-methylacetamido)methyl]-1H-1,3-benzodiazol-1-yl}acetamide

D277-1496 Screening compound: N-butyl-N-methyl-2-{2-[(N-methylacetamido)methyl]-1H-1,3-benzodiazol-1-yl}acetamide
D277-1496 Screening compound: N-butyl-N-methyl-2-{2-[(N-methylacetamido)methyl]-1H-1,3-benzodiazol-1-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D277-1496
N-butyl-N-methyl-2-{2-[(N-methylacetamido)methyl]-1H-1,3-benzodiazol-1-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

D277-1496

Molecular Formula

C18H26N4O2 (C18 H26 N4 O2)

Compound Name

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

IUPAC name

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

SMILES

CCCCN(C)C(Cn1c(cccc2)c2nc1CN(C)C(C)=O)=O

InChI

InChI=1S/C18H26N4O2/c1-5-6-11-20(3)18(24)13-22-16-10-8-7-9-15(16)19-17(22)12-21(4)14(2)23/h7-10H,5-6,11-13H2,1-4H3

InChI Key

ZESBNEFIJAUDKQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12961913

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

330.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.560

Distribution Coefficient, logD

1.559

Water Solubility, LogSw

-1.86

Polar Surface Area

44.178

Acid Dissociation Constant (pKa)

17.85

Base Dissociation Constant (pKb)

4.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

D277-1496 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with D277-1496 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D277-1496?
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What is the minimum amount of D277-1496 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D277-1496
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D277-1496
  • 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 D277-1496 available by request