Y043-5602 Screening compound: (2S)-N-(2-isopropyl-1H-1,3-benzimidazol-6-yl)-4-methyl-2-(1H-pyrrol-1-yl)pentanamide

Y043-5602 Screening compound: (2S)-N-(2-isopropyl-1H-1,3-benzimidazol-6-yl)-4-methyl-2-(1H-pyrrol-1-yl)pentanamide
Y043-5602 Screening compound: (2S)-N-(2-isopropyl-1H-1,3-benzimidazol-6-yl)-4-methyl-2-(1H-pyrrol-1-yl)pentanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y043-5602
(2S)-N-(2-isopropyl-1H-1,3-benzimidazol-6-yl)-4-methyl-2-(1H-pyrrol-1-yl)pentanamide

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

Y043-5602

Molecular Formula

C20H26N4O (C20 H26 N4 O)

Compound Name

(2S)-N-(2-isopropyl-1H-1,3-benzimidazol-6-yl)-4-methyl-2-(1H-pyrrol-1-yl)pentanamide

IUPAC name

(2S)-4-methyl-N-[2-(propan-2-yl)-1H-13-benzodiazol-6-yl]-2-(1H-pyrrol-1-yl)pentanamide

SMILES

CC(C)CC(C(Nc(cc1)cc2c1nc(C(C)C)[nH]2)=O)n1cccc1

InChI

InChI=1S/C20H26N4O/c1-13(2)11-18(24-9-5-6-10-24)20(25)21-15-7-8-16-17(12-15)23-19(22-16)14(3)4/h5-10,12-14,18H,11H2,1-4H3,(H,21,25)(H,22,23)/t18-/m0/s1

InChI Key

JKXPWDWUHQNTSR-SFHVURJKSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

338.45

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.423

Distribution Coefficient, logD

4.419

Water Solubility, LogSw

-4.24

Polar Surface Area

46.415

Acid Dissociation Constant (pKa)

10.86

Base Dissociation Constant (pKb)

5.44

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

References: we are preparing a list of scientific research reports with Y043-5602 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y043-5602?
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What is the minimum amount of Y043-5602 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y043-5602
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y043-5602
  • 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 Y043-5602 available by request