Y010-0350 Screening compound: 1-{N-[(furan-2-yl)methyl]2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropaneamido}-N-(2-methylphenyl)cyclohexane-1-carboxamide

Y010-0350 Screening compound: 1-{N-[(furan-2-yl)methyl]2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropaneamido}-N-(2-methylphenyl)cyclohexane-1-carboxamide
Y010-0350 Screening compound: 1-{N-[(furan-2-yl)methyl]2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropaneamido}-N-(2-methylphenyl)cyclohexane-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y010-0350
1-{N-[(furan-2-yl)methyl]2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropaneamido}-N-(2-methylphenyl)cyclohexane-1-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

Y010-0350

Molecular Formula

C29H38N2O3 (C29 H38 N2 O3)

Compound Name

1-{N-[(furan-2-yl)methyl]2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropaneamido}-N-(2-methylphenyl)cyclohexane-1-carboxamide

IUPAC name

1-{N-[(furan-2-yl)methyl]22-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropaneamido}-N-(2-methylphenyl)cyclohexane-1-carboxamide

SMILES

CC(C)(C1C=C(C)C)C1C(N(Cc1ccco1)C1(CCCCC1)C(Nc1c(C)cccc1)=O)=O

InChI

InChI=1S/C29H38N2O3/c1-20(2)18-23-25(28(23,4)5)26(32)31(19-22-13-11-17-34-22)29(15-9-6-10-16-29)27(33)30-24-14-8-7-12-21(24)3/h7-8,11-14,17-18,23,25H,6,9-10,15-16,19H2,1-5H3,(H,30,33)

InChI Key

DJAZFIUUQBLXNA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06239289

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

462.63

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

7.090

Distribution Coefficient, logD

7.090

Water Solubility, LogSw

-5.45

Polar Surface Area

46.071

Acid Dissociation Constant (pKa)

11.41

Base Dissociation Constant (pKb)

1.71

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

51.70

Y010-0350 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 Y010-0350 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y010-0350?
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What is the minimum amount of Y010-0350 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y010-0350
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y010-0350
  • 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 Y010-0350 available by request