C507-0063 Screening compound: 3-(3-chloro-4-methoxyphenyl)-N-cycloheptyl-5-methyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indole-1-carboxamide

C507-0063 Screening compound: 3-(3-chloro-4-methoxyphenyl)-N-cycloheptyl-5-methyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indole-1-carboxamide
C507-0063 Screening compound: 3-(3-chloro-4-methoxyphenyl)-N-cycloheptyl-5-methyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indole-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C507-0063
3-(3-chloro-4-methoxyphenyl)-N-cycloheptyl-5-methyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indole-1-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

C507-0063

Molecular Formula

C26H27ClN4O3 (C26 H27 ClN4 O3)

Compound Name

3-(3-chloro-4-methoxyphenyl)-N-cycloheptyl-5-methyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indole-1-carboxamide

IUPAC name

3-(3-chloro-4-methoxyphenyl)-N-cycloheptyl-5-methyl-4-oxo-3H4H5H-pyridazino[45-b]indole-1-carboxamide

SMILES

Cn(c1c2cccc1)c1c2C(C(NC2CCCCCC2)=O)=NN(c(cc2)cc(Cl)c2OC)C1=O

InChI

InChI=1S/C26H27ClN4O3/c1-30-20-12-8-7-11-18(20)22-23(25(32)28-16-9-5-3-4-6-10-16)29-31(26(33)24(22)30)17-13-14-21(34-2)19(27)15-17/h7-8,11-16H,3-6,9-10H2,1-2H3,(H,28,32)

InChI Key

FDRHHICUXRIAAI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14762502

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

478.98

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.178

Distribution Coefficient, logD

5.178

Water Solubility, LogSw

-5.88

Polar Surface Area

60.071

Acid Dissociation Constant (pKa)

13.92

Base Dissociation Constant (pKb)

0.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.60

C507-0063 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C507-0063 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C507-0063?
Check Price and Availability of C507-0063, 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 C507-0063 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C507-0063
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C507-0063
  • 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 C507-0063 available by request