D305-0377 Screening compound: N-{2-[(4-benzylpiperazin-1-yl)methyl]-1-methyl-1H-1,3-benzodiazol-5-yl}-2-methylbenzamide

D305-0377 Screening compound: N-{2-[(4-benzylpiperazin-1-yl)methyl]-1-methyl-1H-1,3-benzodiazol-5-yl}-2-methylbenzamide
D305-0377 Screening compound: N-{2-[(4-benzylpiperazin-1-yl)methyl]-1-methyl-1H-1,3-benzodiazol-5-yl}-2-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D305-0377
N-{2-[(4-benzylpiperazin-1-yl)methyl]-1-methyl-1H-1,3-benzodiazol-5-yl}-2-methylbenzamide

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

D305-0377

Molecular Formula

C28H31N5O (C28 H31 N5 O)

Compound Name

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

IUPAC name

N-{2-[(4-benzylpiperazin-1-yl)methyl]-1-methyl-1H-13-benzodiazol-5-yl}-2-methylbenzamide

SMILES

Cc(cccc1)c1C(Nc(cc1)cc2c1n(C)c(CN1CCN(Cc3ccccc3)CC1)n2)=O

InChI

InChI=1S/C28H31N5O/c1-21-8-6-7-11-24(21)28(34)29-23-12-13-26-25(18-23)30-27(31(26)2)20-33-16-14-32(15-17-33)19-22-9-4-3-5-10-22/h3-13,18H,14-17,19-20H2,1-2H3,(H,29,34)

InChI Key

GCSXTAHRZAGNAR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09222879

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

453.59

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.828

Distribution Coefficient, logD

3.558

Water Solubility, LogSw

-3.95

Polar Surface Area

42.589

Acid Dissociation Constant (pKa)

10.44

Base Dissociation Constant (pKb)

7.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

D305-0377 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with D305-0377 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D305-0377?
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What is the minimum amount of D305-0377 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D305-0377
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D305-0377
  • 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 D305-0377 available by request