F912-1132 Screening compound: 5-[(4-methylphenoxy)methyl]-N-(3-{[2-(4-methylpiperazin-1-yl)ethyl]carbamoyl}phenyl)-1,3,4-thiadiazole-2-carboxamide

F912-1132 Screening compound: 5-[(4-methylphenoxy)methyl]-N-(3-{[2-(4-methylpiperazin-1-yl)ethyl]carbamoyl}phenyl)-1,3,4-thiadiazole-2-carboxamide
F912-1132 Screening compound: 5-[(4-methylphenoxy)methyl]-N-(3-{[2-(4-methylpiperazin-1-yl)ethyl]carbamoyl}phenyl)-1,3,4-thiadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F912-1132
5-[(4-methylphenoxy)methyl]-N-(3-{[2-(4-methylpiperazin-1-yl)ethyl]carbamoyl}phenyl)-1,3,4-thiadiazole-2-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

F912-1132

Molecular Formula

C25H30N6O3S (C25 H30 N6 O3 S)

Compound Name

5-[(4-methylphenoxy)methyl]-N-(3-{[2-(4-methylpiperazin-1-yl)ethyl]carbamoyl}phenyl)-1,3,4-thiadiazole-2-carboxamide

IUPAC name

5-[(4-methylphenoxy)methyl]-N-(3-{[2-(4-methylpiperazin-1-yl)ethyl]carbamoyl}phenyl)-134-thiadiazole-2-carboxamide

SMILES

Cc(cc1)ccc1OCc1nnc(C(Nc2cc(C(NCCN3CCN(C)CC3)=O)ccc2)=O)s1

InChI

InChI=1S/C25H30N6O3S/c1-18-6-8-21(9-7-18)34-17-22-28-29-25(35-22)24(33)27-20-5-3-4-19(16-20)23(32)26-10-11-31-14-12-30(2)13-15-31/h3-9,16H,10-15,17H2,1-2H3,(H,26,32)(H,27,33)

InChI Key

ARFZTWOAJYUCNS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14970684

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

494.62

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.486

Distribution Coefficient, logD

1.819

Water Solubility, LogSw

-3.00

Polar Surface Area

86.270

Acid Dissociation Constant (pKa)

11.03

Base Dissociation Constant (pKb)

7.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.00

F912-1132 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic

References: we are preparing a list of scientific research reports with F912-1132 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F912-1132?
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What is the minimum amount of F912-1132 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F912-1132
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F912-1132
  • 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 F912-1132 available by request