C155-0520 Screening compound: 2-{[4-(adamantan-1-yl)phenyl]formamido}-3-(1H-indol-3-yl)-N-(4-methylcyclohexyl)propanamide

Chemical Structure Depiction of ChemDiv screening compound C155-0520
2-{[4-(adamantan-1-yl)phenyl]formamido}-3-(1H-indol-3-yl)-N-(4-methylcyclohexyl)propanamide

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)

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Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

C155-0520

Molecular Formula

C₃₅H₄₃N₃O₂ (C35 H43 N3 O2)

Compound Name

2-{[4-(adamantan-1-yl)phenyl]formamido}-3-(1H-indol-3-yl)-N-(4-methylcyclohexyl)propanamide

IUPAC name

2-{[4-(adamantan-1-yl)phenyl]formamido}-3-(1H-indol-3-yl)-N-(4-methylcyclohexyl)propanamide

SMILES

CC(CC1)CCC1NC(C(Cc1c[nH]c2c1cccc2)NC(c1ccc(C2(CC(C3)C4)CC4CC3C2)cc1)=O)=O

InChI

InChI=1S/C35H43N3O2/c1-22-6-12-29(13-7-22)37-34(40)32(17-27-21-36-31-5-3-2-4-30(27)31)38-33(39)26-8-10-28(11-9-26)35-18-23-14-24(19-35)16-25(15-23)20-35/h2-5,8-11,21-25,29,32,36H,6-7,12-20H2,1H3,(H,37,40)(H,38,39)/t22?,23?,24?,25?,29?,32-,35?/m0/s1

InChI Key

AFKIFFNXOXICKS-SJWBKALDSA-N

MDL Number (MFCD)

MFCD14757587

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

537.75

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

Partition Coefficient, logP

8.514

Distribution Coefficient, logD

8.514

Water Solubility, LogSw

-6.22

Polar Surface Area

58.053

Acid Dissociation Constant (pK_a)

11.56

Base Dissociation Constant (pK_b)

1.30

Number of Chiral Centers

1.00

Percent sp³ carbon bonding

54.30

C155-0520 in Drug Discovery

Included in Screening Libraries

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

CORONAVIRUS Library (20774 compounds)

GABA Library (7115 compounds)

Lipid Metabolism Library (9174 compounds)

PLpro Library (6343 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:

Antiviral
Infections
Immune system
Eye
Cardiovascular
Metabolic
Antiviral
Infections
Immune system
Musculoskeletal
Digestive system
Hemic and lymphatic
Cardiovascular
Skin
wounds
Cancer
Nervous system
Hemic and lymphatic
Endocrine
Immune system
Cancer
Nervous system
Male
Female
Hemic and lymphatic
Skin
Endocrine

Targets:

GPCR
Ion Channels
Phosphatases

Mechanism of action:

Receptor's ligands
Epigenetic

References: we are preparing a list of scientific research reports with C155-0520 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C155-0520?
Check Price and Availability of C155-0520, 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 C155-0520 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.

Delivery options for C155-0520
ChemDiv sends parcels with Express services (UPS, WC).

1–2 days for small orders
2–4 weeks for large selections

Delivery formats for C155-0520

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 C155-0520 available by request