Y080-1977 Screening compound: 2-methyl-N~1~-(2-{1-[4-(2-methylphenoxy)butyl]-1H-1,3-benzimidazol-2-yl}ethyl)propanamide

Y080-1977 Screening compound: 2-methyl-N~1~-(2-{1-[4-(2-methylphenoxy)butyl]-1H-1,3-benzimidazol-2-yl}ethyl)propanamide
Y080-1977 Screening compound: 2-methyl-N~1~-(2-{1-[4-(2-methylphenoxy)butyl]-1H-1,3-benzimidazol-2-yl}ethyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y080-1977
2-methyl-N~1~-(2-{1-[4-(2-methylphenoxy)butyl]-1H-1,3-benzimidazol-2-yl}ethyl)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)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

Y080-1977

Molecular Formula

C24H31N3O2 (C24 H31 N3 O2)

Compound Name

2-methyl-N~1~-(2-{1-[4-(2-methylphenoxy)butyl]-1H-1,3-benzimidazol-2-yl}ethyl)propanamide

IUPAC name

2-methyl-N-(2-{1-[4-(2-methylphenoxy)butyl]-1H-13-benzodiazol-2-yl}ethyl)propanamide

SMILES

CC(C)C(NCCc1nc(cccc2)c2n1CCCCOc1c(C)cccc1)=O

InChI

InChI=1S/C24H31N3O2/c1-18(2)24(28)25-15-14-23-26-20-11-5-6-12-21(20)27(23)16-8-9-17-29-22-13-7-4-10-19(22)3/h4-7,10-13,18H,8-9,14-17H2,1-3H3,(H,25,28)

InChI Key

GGFXBLREKDQKHF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04217597

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.53

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.667

Distribution Coefficient, logD

4.665

Water Solubility, LogSw

-4.30

Polar Surface Area

43.152

Acid Dissociation Constant (pKa)

14.46

Base Dissociation Constant (pKb)

5.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.67

References: we are preparing a list of scientific research reports with Y080-1977 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y080-1977?
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What is the minimum amount of Y080-1977 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y080-1977
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y080-1977
  • 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 Y080-1977 available by request