C523-2717 Screening compound: N-(4-methylcyclohexyl)-2-({[5-methyl-2-(3-methyl-2-thienyl)-1,3-oxazol-4-yl]methyl}sulfanyl)acetamide

C523-2717 Screening compound: N-(4-methylcyclohexyl)-2-({[5-methyl-2-(3-methyl-2-thienyl)-1,3-oxazol-4-yl]methyl}sulfanyl)acetamide
C523-2717 Screening compound: N-(4-methylcyclohexyl)-2-({[5-methyl-2-(3-methyl-2-thienyl)-1,3-oxazol-4-yl]methyl}sulfanyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C523-2717
N-(4-methylcyclohexyl)-2-({[5-methyl-2-(3-methyl-2-thienyl)-1,3-oxazol-4-yl]methyl}sulfanyl)acetamide

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

C523-2717

Molecular Formula

C19H26N2O2S2 (C19 H26 N2 O2 S2)

Compound Name

N-(4-methylcyclohexyl)-2-({[5-methyl-2-(3-methyl-2-thienyl)-1,3-oxazol-4-yl]methyl}sulfanyl)acetamide

IUPAC name

2-({[5-methyl-2-(3-methylthiophen-2-yl)-13-oxazol-4-yl]methyl}sulfanyl)-N-(4-methylcyclohexyl)acetamide

SMILES

CC(CC1)CCC1NC(CSCc1c(C)oc(-c2c(C)ccs2)n1)=O

InChI

InChI=1S/C19H26N2O2S2/c1-12-4-6-15(7-5-12)20-17(22)11-24-10-16-14(3)23-19(21-16)18-13(2)8-9-25-18/h8-9,12,15H,4-7,10-11H2,1-3H3,(H,20,22)

InChI Key

LDRMIMQJGJTHJV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14766419

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

378.56

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.343

Distribution Coefficient, logD

5.343

Water Solubility, LogSw

-5.29

Polar Surface Area

43.304

Acid Dissociation Constant (pKa)

15.26

Base Dissociation Constant (pKb)

-0.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.90

C523-2717 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C523-2717 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C523-2717?
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What is the minimum amount of C523-2717 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C523-2717
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C523-2717
  • 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 C523-2717 available by request