F187-0380 Screening compound: 4-[5-amino-4-(1,3-benzothiazol-2-yl)-3-oxo-2,3-dihydro-1H-pyrrol-1-yl]-N-propylbenzamide

F187-0380 Screening compound: 4-[5-amino-4-(1,3-benzothiazol-2-yl)-3-oxo-2,3-dihydro-1H-pyrrol-1-yl]-N-propylbenzamide
F187-0380 Screening compound: 4-[5-amino-4-(1,3-benzothiazol-2-yl)-3-oxo-2,3-dihydro-1H-pyrrol-1-yl]-N-propylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F187-0380
4-[5-amino-4-(1,3-benzothiazol-2-yl)-3-oxo-2,3-dihydro-1H-pyrrol-1-yl]-N-propylbenzamide

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

F187-0380

Molecular Formula

C21H20N4O2S (C21 H20 N4 O2 S)

Compound Name

4-[5-amino-4-(1,3-benzothiazol-2-yl)-3-oxo-2,3-dihydro-1H-pyrrol-1-yl]-N-propylbenzamide

IUPAC name

4-[5-amino-4-(13-benzothiazol-2-yl)-3-oxo-23-dihydro-1H-pyrrol-1-yl]-N-propylbenzamide

SMILES

CCCNC(c(cc1)ccc1N(CC1=O)C(N)=C1c1nc(cccc2)c2s1)=O

InChI

InChI=1S/C21H20N4O2S/c1-2-11-23-20(27)13-7-9-14(10-8-13)25-12-16(26)18(19(25)22)21-24-15-5-3-4-6-17(15)28-21/h3-10H,2,11-12,22H2,1H3,(H,23,27)

InChI Key

JWSLPIUAFHJOAW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27107947

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.48

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.043

Distribution Coefficient, logD

3.043

Water Solubility, LogSw

-3.47

Polar Surface Area

70.946

Acid Dissociation Constant (pKa)

14.01

Base Dissociation Constant (pKb)

-1.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

References: we are preparing a list of scientific research reports with F187-0380 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F187-0380?
Check Price and Availability of F187-0380, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of F187-0380 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F187-0380
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F187-0380
  • 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 F187-0380 available by request