C155-0745 Screening compound: methyl 3-methyl-2-(3-methyl-2-{[4-(4-propylcyclohexyl)phenyl]formamido}butanamido)butanoate

C155-0745 Screening compound: methyl 3-methyl-2-(3-methyl-2-{[4-(4-propylcyclohexyl)phenyl]formamido}butanamido)butanoate
C155-0745 Screening compound: methyl 3-methyl-2-(3-methyl-2-{[4-(4-propylcyclohexyl)phenyl]formamido}butanamido)butanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound C155-0745
methyl 3-methyl-2-(3-methyl-2-{[4-(4-propylcyclohexyl)phenyl]formamido}butanamido)butanoate

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

C155-0745

Molecular Formula

C27H42N2O4 (C27 H42 N2 O4)

Compound Name

methyl 3-methyl-2-(3-methyl-2-{[4-(4-propylcyclohexyl)phenyl]formamido}butanamido)butanoate

IUPAC name

methyl 3-methyl-2-(3-methyl-2-{[4-(4-propylcyclohexyl)phenyl]formamido}butanamido)butanoate

SMILES

CCCC(CC1)CCC1c(cc1)ccc1C(NC(C(C)C)C(NC(C(C)C)C(OC)=O)=O)=O

InChI

InChI=1S/C27H42N2O4/c1-7-8-19-9-11-20(12-10-19)21-13-15-22(16-14-21)25(30)28-23(17(2)3)26(31)29-24(18(4)5)27(32)33-6/h13-20,23-24H,7-12H2,1-6H3,(H,28,30)(H,29,31)

InChI Key

JJBSOKGERYFEPR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14723353

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

458.64

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.428

Distribution Coefficient, logD

6.428

Water Solubility, LogSw

-5.74

Polar Surface Area

69.407

Acid Dissociation Constant (pKa)

13.16

Base Dissociation Constant (pKb)

-0.85

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

66.70

C155-0745 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with C155-0745 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C155-0745?
Check Price and Availability of C155-0745, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of C155-0745 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C155-0745
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C155-0745
  • 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 C155-0745 available by request