8019-0385 Screening compound: 1-[2-(cyclohex-1-en-1-yl)ethyl]-3-(4-fluorobenzenesulfonyl)-4,5-dimethyl-1H-pyrrol-2-amine

8019-0385 Screening compound: 1-[2-(cyclohex-1-en-1-yl)ethyl]-3-(4-fluorobenzenesulfonyl)-4,5-dimethyl-1H-pyrrol-2-amine
8019-0385 Screening compound: 1-[2-(cyclohex-1-en-1-yl)ethyl]-3-(4-fluorobenzenesulfonyl)-4,5-dimethyl-1H-pyrrol-2-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-0385
1-[2-(cyclohex-1-en-1-yl)ethyl]-3-(4-fluorobenzenesulfonyl)-4,5-dimethyl-1H-pyrrol-2-amine

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

8019-0385

Molecular Formula

C20H25FN2O2S (C20 H25 FN2 O2 S)

Compound Name

1-[2-(cyclohex-1-en-1-yl)ethyl]-3-(4-fluorobenzenesulfonyl)-4,5-dimethyl-1H-pyrrol-2-amine

IUPAC name

1-[2-(cyclohex-1-en-1-yl)ethyl]-3-(4-fluorobenzenesulfonyl)-45-dimethyl-1H-pyrrol-2-amine

SMILES

Cc1c(C)n(CCC2=CCCCC2)c(N)c1S(c(cc1)ccc1F)(=O)=O

InChI

InChI=1S/C20H25FN2O2S/c1-14-15(2)23(13-12-16-6-4-3-5-7-16)20(22)19(14)26(24,25)18-10-8-17(21)9-11-18/h6,8-11H,3-5,7,12-13,22H2,1-2H3

InChI Key

ZFKXQPSZXVVXTA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09063885

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

376.5

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.893

Distribution Coefficient, logD

3.893

Water Solubility, LogSw

-4.01

Polar Surface Area

50.858

Acid Dissociation Constant (pKa)

19.13

Base Dissociation Constant (pKb)

-2.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

References: we are preparing a list of scientific research reports with 8019-0385 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-0385?
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What is the minimum amount of 8019-0385 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-0385
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-0385
  • 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 8019-0385 available by request