C779-1193 Screening compound: 1-{4-ethyl-4H-thieno[3,2-b]pyrrole-5-carbonyl}-N-[3-(4-methylpiperazin-1-yl)propyl]piperidine-4-carboxamide

C779-1193 Screening compound: 1-{4-ethyl-4H-thieno[3,2-b]pyrrole-5-carbonyl}-N-[3-(4-methylpiperazin-1-yl)propyl]piperidine-4-carboxamide
C779-1193 Screening compound: 1-{4-ethyl-4H-thieno[3,2-b]pyrrole-5-carbonyl}-N-[3-(4-methylpiperazin-1-yl)propyl]piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C779-1193
1-{4-ethyl-4H-thieno[3,2-b]pyrrole-5-carbonyl}-N-[3-(4-methylpiperazin-1-yl)propyl]piperidine-4-carboxamide

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

C779-1193

Molecular Formula

C23H35N5O2S (C23 H35 N5 O2 S)

Compound Name

1-{4-ethyl-4H-thieno[3,2-b]pyrrole-5-carbonyl}-N-[3-(4-methylpiperazin-1-yl)propyl]piperidine-4-carboxamide

IUPAC name

1-{4-ethyl-4H-thieno[32-b]pyrrole-5-carbonyl}-N-[3-(4-methylpiperazin-1-yl)propyl]piperidine-4-carboxamide

SMILES

CCn(c(C(N(CC1)CCC1C(NCCCN1CCN(C)CC1)=O)=O)c1)c2c1scc2

InChI

InChI=1S/C23H35N5O2S/c1-3-28-19-7-16-31-21(19)17-20(28)23(30)27-10-5-18(6-11-27)22(29)24-8-4-9-26-14-12-25(2)13-15-26/h7,16-18H,3-6,8-15H2,1-2H3,(H,24,29)

InChI Key

KWEANQWDVLXGIY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26966309

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

445.63

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.401

Distribution Coefficient, logD

0.197

Water Solubility, LogSw

-2.38

Polar Surface Area

50.069

Acid Dissociation Constant (pKa)

15.07

Base Dissociation Constant (pKb)

8.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

65.20

C779-1193 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with C779-1193 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C779-1193?
Check Price and Availability of C779-1193, 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 C779-1193 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C779-1193
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C779-1193
  • 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 C779-1193 available by request