C799-0383 Screening compound: N~1~-(4-ethoxy-3-methoxybenzyl)-4-[6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl]butanamide

C799-0383 Screening compound: N~1~-(4-ethoxy-3-methoxybenzyl)-4-[6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl]butanamide
C799-0383 Screening compound: N~1~-(4-ethoxy-3-methoxybenzyl)-4-[6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C799-0383
N~1~-(4-ethoxy-3-methoxybenzyl)-4-[6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl]butanamide

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

C799-0383

Molecular Formula

C24H26N4O4 (C24 H26 N4 O4)

Compound Name

N~1~-(4-ethoxy-3-methoxybenzyl)-4-[6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl]butanamide

IUPAC name

N-[(4-ethoxy-3-methoxyphenyl)methyl]-4-{7-oxo-2810-triazatricyclo[7.4.0.0^{26}]trideca-1(13)35911-pentaen-8-yl}butanamide

SMILES

CCOc(ccc(CNC(CCCN(C1=O)c2ncccc2-n2c1ccc2)=O)c1)c1OC

InChI

InChI=1S/C24H26N4O4/c1-3-32-20-11-10-17(15-21(20)31-2)16-26-22(29)9-6-14-28-23-18(7-4-12-25-23)27-13-5-8-19(27)24(28)30/h4-5,7-8,10-13,15H,3,6,9,14,16H2,1-2H3,(H,26,29)

InChI Key

ZUMIBXXDXLRICR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14799487

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.49

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.171

Distribution Coefficient, logD

2.171

Water Solubility, LogSw

-2.63

Polar Surface Area

66.587

Acid Dissociation Constant (pKa)

14.52

Base Dissociation Constant (pKb)

1.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

C799-0383 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin

References: we are preparing a list of scientific research reports with C799-0383 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C799-0383?
Check Price and Availability of C799-0383, 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 C799-0383 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C799-0383
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C799-0383
  • 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 C799-0383 available by request