M050-3150 Screening compound: 4-amino-N5-[(3,5-difluorophenyl)methyl]-N3-(propan-2-yl)-1,2-thiazole-3,5-dicarboxamide

M050-3150 Screening compound: 4-amino-N5-[(3,5-difluorophenyl)methyl]-N3-(propan-2-yl)-1,2-thiazole-3,5-dicarboxamide
M050-3150 Screening compound: 4-amino-N5-[(3,5-difluorophenyl)methyl]-N3-(propan-2-yl)-1,2-thiazole-3,5-dicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M050-3150
4-amino-N5-[(3,5-difluorophenyl)methyl]-N3-(propan-2-yl)-1,2-thiazole-3,5-dicarboxamide

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

M050-3150

Molecular Formula

C15H16F2N4O2S (C15 H16 F2 N4 O2 S)

Compound Name

4-amino-N5-[(3,5-difluorophenyl)methyl]-N3-(propan-2-yl)-1,2-thiazole-3,5-dicarboxamide

IUPAC name

4-amino-N5-[(35-difluorophenyl)methyl]-N3-(propan-2-yl)-12-thiazole-35-dicarboxamide

SMILES

CC(C)NC(c1nsc(C(NCc2cc(F)cc(F)c2)=O)c1N)=O

InChI

InChI=1S/C15H16F2N4O2S/c1-7(2)20-14(22)12-11(18)13(24-21-12)15(23)19-6-8-3-9(16)5-10(17)4-8/h3-5,7H,6,18H2,1-2H3,(H,19,23)(H,20,22)

InChI Key

SWSDYWSXOYKBKF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27494443

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.38

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.097

Distribution Coefficient, logD

2.097

Water Solubility, LogSw

-2.59

Polar Surface Area

78.959

Acid Dissociation Constant (pKa)

11.66

Base Dissociation Constant (pKb)

-1.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

M050-3150 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with M050-3150 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M050-3150?
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What is the minimum amount of M050-3150 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M050-3150
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M050-3150
  • 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 M050-3150 available by request