F912-0270 Screening compound: N-[3-({3-[methyl(phenyl)amino]propyl}carbamoyl)phenyl]-5-(phenoxymethyl)-1,3,4-thiadiazole-2-carboxamide

F912-0270 Screening compound: N-[3-({3-[methyl(phenyl)amino]propyl}carbamoyl)phenyl]-5-(phenoxymethyl)-1,3,4-thiadiazole-2-carboxamide
F912-0270 Screening compound: N-[3-({3-[methyl(phenyl)amino]propyl}carbamoyl)phenyl]-5-(phenoxymethyl)-1,3,4-thiadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F912-0270
N-[3-({3-[methyl(phenyl)amino]propyl}carbamoyl)phenyl]-5-(phenoxymethyl)-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

F912-0270

Molecular Formula

C27H27N5O3S (C27 H27 N5 O3 S)

Compound Name

N-[3-({3-[methyl(phenyl)amino]propyl}carbamoyl)phenyl]-5-(phenoxymethyl)-1,3,4-thiadiazole-2-carboxamide

IUPAC name

N-[3-({3-[methyl(phenyl)amino]propyl}carbamoyl)phenyl]-5-(phenoxymethyl)-134-thiadiazole-2-carboxamide

SMILES

CN(CCCNC(c1cccc(NC(c2nnc(COc3ccccc3)s2)=O)c1)=O)c1ccccc1

InChI

InChI=1S/C27H27N5O3S/c1-32(22-12-4-2-5-13-22)17-9-16-28-25(33)20-10-8-11-21(18-20)29-26(34)27-31-30-24(36-27)19-35-23-14-6-3-7-15-23/h2-8,10-15,18H,9,16-17,19H2,1H3,(H,28,33)(H,29,34)

InChI Key

OSNUZXRUNSVCKT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14970418

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

501.61

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.897

Distribution Coefficient, logD

3.892

Water Solubility, LogSw

-3.91

Polar Surface Area

82.016

Acid Dissociation Constant (pKa)

11.03

Base Dissociation Constant (pKb)

8.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.50

F912-0270 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F912-0270 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F912-0270?
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What is the minimum amount of F912-0270 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F912-0270
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F912-0270
  • 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 F912-0270 available by request