G795-0411 Screening compound: N-{5-[4-(3-methoxyphenyl)piperazine-1-carbonyl]-2-methylphenyl}-1,2-benzothiazole-3-carboxamide

G795-0411 Screening compound: N-{5-[4-(3-methoxyphenyl)piperazine-1-carbonyl]-2-methylphenyl}-1,2-benzothiazole-3-carboxamide
G795-0411 Screening compound: N-{5-[4-(3-methoxyphenyl)piperazine-1-carbonyl]-2-methylphenyl}-1,2-benzothiazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G795-0411
N-{5-[4-(3-methoxyphenyl)piperazine-1-carbonyl]-2-methylphenyl}-1,2-benzothiazole-3-carboxamide

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

G795-0411

Molecular Formula

C27H26N4O3S (C27 H26 N4 O3 S)

Compound Name

N-{5-[4-(3-methoxyphenyl)piperazine-1-carbonyl]-2-methylphenyl}-1,2-benzothiazole-3-carboxamide

IUPAC name

N-{5-[4-(3-methoxyphenyl)piperazine-1-carbonyl]-2-methylphenyl}-12-benzothiazole-3-carboxamide

SMILES

Cc(ccc(C(N(CC1)CCN1c1cc(OC)ccc1)=O)c1)c1NC(c1nsc2c1cccc2)=O

InChI

InChI=1S/C27H26N4O3S/c1-18-10-11-19(16-23(18)28-26(32)25-22-8-3-4-9-24(22)35-29-25)27(33)31-14-12-30(13-15-31)20-6-5-7-21(17-20)34-2/h3-11,16-17H,12-15H2,1-2H3,(H,28,32)

InChI Key

FIPYTKVSVTUDNJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27159753

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

486.59

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

4.574

Distribution Coefficient, logD

4.574

Water Solubility, LogSw

-4.34

Polar Surface Area

61.075

Acid Dissociation Constant (pKa)

13.66

Base Dissociation Constant (pKb)

2.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

G795-0411 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with G795-0411 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G795-0411?
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What is the minimum amount of G795-0411 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G795-0411
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G795-0411
  • 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 G795-0411 available by request