V030-6115 Screening compound: N~2~-(4-butyl-3-ethyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-7-yl)-2-furamide

V030-6115 Screening compound: N~2~-(4-butyl-3-ethyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-7-yl)-2-furamide
V030-6115 Screening compound: N~2~-(4-butyl-3-ethyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-7-yl)-2-furamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-6115
N~2~-(4-butyl-3-ethyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-7-yl)-2-furamide

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

V030-6115

Molecular Formula

C18H21N3O4S (C18 H21 N3 O4 S)

Compound Name

N~2~-(4-butyl-3-ethyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-7-yl)-2-furamide

IUPAC name

N-(4-butyl-3-ethyl-11-dioxo-4H-1lambda624-benzothiadiazin-7-yl)furan-2-carboxamide

SMILES

CCCCN(C(CC)=N1)c(ccc(NC(c2ccco2)=O)c2)c2S1(=O)=O

InChI

InChI=1S/C18H21N3O4S/c1-3-5-10-21-14-9-8-13(19-18(22)15-7-6-11-25-15)12-16(14)26(23,24)20-17(21)4-2/h6-9,11-12H,3-5,10H2,1-2H3,(H,19,22)

InChI Key

FMBFQCHYZSWMEE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20499669

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

375.45

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.249

Distribution Coefficient, logD

3.247

Water Solubility, LogSw

-3.60

Polar Surface Area

75.339

Acid Dissociation Constant (pKa)

9.68

Base Dissociation Constant (pKb)

2.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

V030-6115 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with V030-6115 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-6115?
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What is the minimum amount of V030-6115 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-6115
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-6115
  • 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 V030-6115 available by request