C154-0273 Screening compound: 6,7-dimethoxy-N,2-dimethyl-1-oxo-N-[4-(propan-2-yl)phenyl]-1,2-dihydroisoquinoline-4-carboxamide

C154-0273 Screening compound: 6,7-dimethoxy-N,2-dimethyl-1-oxo-N-[4-(propan-2-yl)phenyl]-1,2-dihydroisoquinoline-4-carboxamide
C154-0273 Screening compound: 6,7-dimethoxy-N,2-dimethyl-1-oxo-N-[4-(propan-2-yl)phenyl]-1,2-dihydroisoquinoline-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C154-0273
6,7-dimethoxy-N,2-dimethyl-1-oxo-N-[4-(propan-2-yl)phenyl]-1,2-dihydroisoquinoline-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

C154-0273

Molecular Formula

C23H26N2O4 (C23 H26 N2 O4)

Compound Name

6,7-dimethoxy-N,2-dimethyl-1-oxo-N-[4-(propan-2-yl)phenyl]-1,2-dihydroisoquinoline-4-carboxamide

IUPAC name

67-dimethoxy-N2-dimethyl-1-oxo-N-[4-(propan-2-yl)phenyl]-12-dihydroisoquinoline-4-carboxamide

SMILES

CC(C)c(cc1)ccc1N(C)C(C(c(cc1OC)c2cc1OC)=CN(C)C2=O)=O

InChI

InChI=1S/C23H26N2O4/c1-14(2)15-7-9-16(10-8-15)25(4)23(27)19-13-24(3)22(26)18-12-21(29-6)20(28-5)11-17(18)19/h7-14H,1-6H3

InChI Key

ZEAZQMWKOXIILR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14723272

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.47

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.122

Distribution Coefficient, logD

3.122

Water Solubility, LogSw

-3.29

Polar Surface Area

46.817

Acid Dissociation Constant (pKa)

24.08

Base Dissociation Constant (pKb)

0.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

C154-0273 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C154-0273 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C154-0273?
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What is the minimum amount of C154-0273 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C154-0273
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C154-0273
  • 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 C154-0273 available by request