M057-2456 Screening compound: N-[1-(4-methoxyphenyl)ethyl]-4-(propan-2-yl)-2-(1H-pyrrol-1-yl)-1,3-thiazole-5-carboxamide

M057-2456 Screening compound: N-[1-(4-methoxyphenyl)ethyl]-4-(propan-2-yl)-2-(1H-pyrrol-1-yl)-1,3-thiazole-5-carboxamide
M057-2456 Screening compound: N-[1-(4-methoxyphenyl)ethyl]-4-(propan-2-yl)-2-(1H-pyrrol-1-yl)-1,3-thiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M057-2456
N-[1-(4-methoxyphenyl)ethyl]-4-(propan-2-yl)-2-(1H-pyrrol-1-yl)-1,3-thiazole-5-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

M057-2456

Molecular Formula

C20H23N3O2S (C20 H23 N3 O2 S)

Compound Name

N-[1-(4-methoxyphenyl)ethyl]-4-(propan-2-yl)-2-(1H-pyrrol-1-yl)-1,3-thiazole-5-carboxamide

IUPAC name

N-[1-(4-methoxyphenyl)ethyl]-4-(propan-2-yl)-2-(1H-pyrrol-1-yl)-13-thiazole-5-carboxamide

SMILES

CC(C)c1c(C(NC(C)c(cc2)ccc2OC)=O)sc(-n2cccc2)n1

InChI

InChI=1S/C20H23N3O2S/c1-13(2)17-18(26-20(22-17)23-11-5-6-12-23)19(24)21-14(3)15-7-9-16(25-4)10-8-15/h5-14H,1-4H3,(H,21,24)/t14-/m0/s1

InChI Key

MLGQFIFQIQBLCS-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD27494598

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

369.49

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.037

Distribution Coefficient, logD

5.030

Water Solubility, LogSw

-4.62

Polar Surface Area

45.935

Acid Dissociation Constant (pKa)

12.35

Base Dissociation Constant (pKb)

5.63

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.00

References: we are preparing a list of scientific research reports with M057-2456 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M057-2456?
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What is the minimum amount of M057-2456 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M057-2456
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M057-2456
  • 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 M057-2456 available by request