D305-0199 Screening compound: N-{2-[(4-ethylpiperazin-1-yl)methyl]-1-methyl-1H-1,3-benzodiazol-5-yl}-4-methoxybenzamide

D305-0199 Screening compound: N-{2-[(4-ethylpiperazin-1-yl)methyl]-1-methyl-1H-1,3-benzodiazol-5-yl}-4-methoxybenzamide
D305-0199 Screening compound: N-{2-[(4-ethylpiperazin-1-yl)methyl]-1-methyl-1H-1,3-benzodiazol-5-yl}-4-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D305-0199
N-{2-[(4-ethylpiperazin-1-yl)methyl]-1-methyl-1H-1,3-benzodiazol-5-yl}-4-methoxybenzamide

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

D305-0199

Molecular Formula

C23H29N5O2 (C23 H29 N5 O2)

Compound Name

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

IUPAC name

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

SMILES

CCN1CCN(Cc2nc(cc(cc3)NC(c(cc4)ccc4OC)=O)c3n2C)CC1

InChI

InChI=1S/C23H29N5O2/c1-4-27-11-13-28(14-12-27)16-22-25-20-15-18(7-10-21(20)26(22)2)24-23(29)17-5-8-19(30-3)9-6-17/h5-10,15H,4,11-14,16H2,1-3H3,(H,24,29)

InChI Key

DJSGEGKDZSAZTC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09164557

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

407.52

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

2.438

Distribution Coefficient, logD

1.327

Water Solubility, LogSw

-2.96

Polar Surface Area

50.129

Acid Dissociation Constant (pKa)

11.29

Base Dissociation Constant (pKb)

8.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

D305-0199 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 D305-0199 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D305-0199?
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What is the minimum amount of D305-0199 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D305-0199
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D305-0199
  • 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 D305-0199 available by request