V027-7491 Screening compound: N~2~-ethyl-6,7-dimethoxy-1-[(propionylamino)methyl]-3,4-dihydro-2(1H)-isoquinolinecarboxamide

V027-7491 Screening compound: N~2~-ethyl-6,7-dimethoxy-1-[(propionylamino)methyl]-3,4-dihydro-2(1H)-isoquinolinecarboxamide
V027-7491 Screening compound: N~2~-ethyl-6,7-dimethoxy-1-[(propionylamino)methyl]-3,4-dihydro-2(1H)-isoquinolinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V027-7491
N~2~-ethyl-6,7-dimethoxy-1-[(propionylamino)methyl]-3,4-dihydro-2(1H)-isoquinolinecarboxamide

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

V027-7491

Molecular Formula

C18H27N3O4 (C18 H27 N3 O4)

Compound Name

N~2~-ethyl-6,7-dimethoxy-1-[(propionylamino)methyl]-3,4-dihydro-2(1H)-isoquinolinecarboxamide

IUPAC name

N-ethyl-67-dimethoxy-1-(propanamidomethyl)-1234-tetrahydroisoquinoline-2-carboxamide

SMILES

CCC(NCC(c(cc1OC)c(CC2)cc1OC)N2C(NCC)=O)=O

InChI

InChI=1S/C18H27N3O4/c1-5-17(22)20-11-14-13-10-16(25-4)15(24-3)9-12(13)7-8-21(14)18(23)19-6-2/h9-10,14H,5-8,11H2,1-4H3,(H,19,23)(H,20,22)/t14-/m0/s1

InChI Key

PVAOEFXFPRJXGV-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD19832245

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

349.43

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.998

Distribution Coefficient, logD

0.998

Water Solubility, LogSw

-1.85

Polar Surface Area

65.858

Acid Dissociation Constant (pKa)

14.58

Base Dissociation Constant (pKb)

0.62

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

55.56

References: we are preparing a list of scientific research reports with V027-7491 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V027-7491?
Check Price and Availability of V027-7491, 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 V027-7491 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V027-7491
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V027-7491
  • 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 V027-7491 available by request