C358-0115 Screening compound: N-[3-(4-ethylpiperazin-1-yl)propyl]-2,3-dimethoxy-5-oxo-7,8,12b,13-tetrahydro-5H-6-azatetraphene-13-carboxamide

C358-0115 Screening compound: N-[3-(4-ethylpiperazin-1-yl)propyl]-2,3-dimethoxy-5-oxo-7,8,12b,13-tetrahydro-5H-6-azatetraphene-13-carboxamide
C358-0115 Screening compound: N-[3-(4-ethylpiperazin-1-yl)propyl]-2,3-dimethoxy-5-oxo-7,8,12b,13-tetrahydro-5H-6-azatetraphene-13-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C358-0115
N-[3-(4-ethylpiperazin-1-yl)propyl]-2,3-dimethoxy-5-oxo-7,8,12b,13-tetrahydro-5H-6-azatetraphene-13-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

C358-0115

Molecular Formula

C29H38N4O4 (C29 H38 N4 O4)

Compound Name

N-[3-(4-ethylpiperazin-1-yl)propyl]-2,3-dimethoxy-5-oxo-7,8,12b,13-tetrahydro-5H-6-azatetraphene-13-carboxamide

IUPAC name

N-[3-(4-ethylpiperazin-1-yl)propyl]-23-dimethoxy-5-oxo-7812b13-tetrahydro-5H-6-azatetraphene-13-carboxamide

SMILES

CCN1CCN(CCCNC(C(C2N3CCc4c2cccc4)c(cc(c(OC)c2)OC)c2C3=O)=O)CC1

InChI

InChI=1S/C29H38N4O4/c1-4-31-14-16-32(17-15-31)12-7-11-30-28(34)26-22-18-24(36-2)25(37-3)19-23(22)29(35)33-13-10-20-8-5-6-9-21(20)27(26)33/h5-6,8-9,18-19,26-27H,4,7,10-17H2,1-3H3,(H,30,34)

InChI Key

QVYCFLCUTNYSHA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14752415

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

506.65

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.962

Distribution Coefficient, logD

1.014

Water Solubility, LogSw

-2.63

Polar Surface Area

62.981

Acid Dissociation Constant (pKa)

12.44

Base Dissociation Constant (pKb)

8.30

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

51.70

C358-0115 in Drug Discovery

Included in Screening Libraries

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with C358-0115 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C358-0115?
Check Price and Availability of C358-0115, 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 C358-0115 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C358-0115
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C358-0115
  • 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 C358-0115 available by request