F340-0191 Screening compound: 4-tert-butyl-N-[(E)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(3-ethylphenyl)carbamimidoyl]benzamide

F340-0191 Screening compound: 4-tert-butyl-N-[(E)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(3-ethylphenyl)carbamimidoyl]benzamide
F340-0191 Screening compound: 4-tert-butyl-N-[(E)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(3-ethylphenyl)carbamimidoyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F340-0191
4-tert-butyl-N-[(E)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(3-ethylphenyl)carbamimidoyl]benzamide

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

F340-0191

Molecular Formula

C28H37N5O (C28 H37 N5 O)

Compound Name

4-tert-butyl-N-[(E)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(3-ethylphenyl)carbamimidoyl]benzamide

IUPAC name

4-tert-butyl-N-[(E)-N-[(1-ethyl-35-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(3-ethylphenyl)carbamimidoyl]benzamide

SMILES

CCc1cccc(/N=C(\NCc2c(C)n(CC)nc2C)/NC(c2ccc(C(C)(C)C)cc2)=O)c1

InChI

InChI=1S/C28H37N5O/c1-8-21-11-10-12-24(17-21)30-27(29-18-25-19(3)32-33(9-2)20(25)4)31-26(34)22-13-15-23(16-14-22)28(5,6)7/h10-17H,8-9,18H2,1-7H3,(H2,29,30,31,34)

InChI Key

WOUUIGQWESYXTN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14948862

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

459.63

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.991

Distribution Coefficient, logD

5.274

Water Solubility, LogSw

-5.47

Polar Surface Area

56.129

Acid Dissociation Constant (pKa)

11.68

Base Dissociation Constant (pKb)

8.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.30

References: we are preparing a list of scientific research reports with F340-0191 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F340-0191?
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What is the minimum amount of F340-0191 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F340-0191
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F340-0191
  • 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 F340-0191 available by request