P497-1805 Screening compound: methyl 3-[2-(4-methyl-5-{[(4-methylphenyl)methyl]carbamoyl}-1,3-thiazol-2-yl)acetamido]benzoate

P497-1805 Screening compound: methyl 3-[2-(4-methyl-5-{[(4-methylphenyl)methyl]carbamoyl}-1,3-thiazol-2-yl)acetamido]benzoate
P497-1805 Screening compound: methyl 3-[2-(4-methyl-5-{[(4-methylphenyl)methyl]carbamoyl}-1,3-thiazol-2-yl)acetamido]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound P497-1805
methyl 3-[2-(4-methyl-5-{[(4-methylphenyl)methyl]carbamoyl}-1,3-thiazol-2-yl)acetamido]benzoate

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

P497-1805

Molecular Formula

C23H23N3O4S (C23 H23 N3 O4 S)

Compound Name

methyl 3-[2-(4-methyl-5-{[(4-methylphenyl)methyl]carbamoyl}-1,3-thiazol-2-yl)acetamido]benzoate

IUPAC name

methyl 3-[2-(4-methyl-5-{[(4-methylphenyl)methyl]carbamoyl}-13-thiazol-2-yl)acetamido]benzoate

SMILES

Cc1c(C(NCc2ccc(C)cc2)=O)sc(CC(Nc2cc(C(OC)=O)ccc2)=O)n1

InChI

InChI=1S/C23H23N3O4S/c1-14-7-9-16(10-8-14)13-24-22(28)21-15(2)25-20(31-21)12-19(27)26-18-6-4-5-17(11-18)23(29)30-3/h4-11H,12-13H2,1-3H3,(H,24,28)(H,26,27)

InChI Key

SEVBFPJGFSEBMQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27576500

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

437.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.140

Distribution Coefficient, logD

4.140

Water Solubility, LogSw

-4.28

Polar Surface Area

79.781

Acid Dissociation Constant (pKa)

11.83

Base Dissociation Constant (pKb)

-1.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

References: we are preparing a list of scientific research reports with P497-1805 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P497-1805?
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What is the minimum amount of P497-1805 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P497-1805
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P497-1805
  • 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 P497-1805 available by request