V029-2515 Screening compound: N-(3-bromophenyl)-4-(3-methylphenyl)-3-oxo-1-thia-4,8-diazaspiro[4.5]decane-8-carboxamide

V029-2515 Screening compound: N-(3-bromophenyl)-4-(3-methylphenyl)-3-oxo-1-thia-4,8-diazaspiro[4.5]decane-8-carboxamide
V029-2515 Screening compound: N-(3-bromophenyl)-4-(3-methylphenyl)-3-oxo-1-thia-4,8-diazaspiro[4.5]decane-8-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-2515
N-(3-bromophenyl)-4-(3-methylphenyl)-3-oxo-1-thia-4,8-diazaspiro[4.5]decane-8-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

V029-2515

Molecular Formula

C21H22BrN3O2S (C21 H22 BrN3 O2 S)

Compound Name

N-(3-bromophenyl)-4-(3-methylphenyl)-3-oxo-1-thia-4,8-diazaspiro[4.5]decane-8-carboxamide

IUPAC name

N-(3-bromophenyl)-4-(3-methylphenyl)-3-oxo-1-thia-48-diazaspiro[4.5]decane-8-carboxamide

SMILES

Cc1cccc(N(C(CC2)(CCN2C(Nc2cccc(Br)c2)=O)SC2)C2=O)c1

InChI

InChI=1S/C21H22BrN3O2S/c1-15-4-2-7-18(12-15)25-19(26)14-28-21(25)8-10-24(11-9-21)20(27)23-17-6-3-5-16(22)13-17/h2-7,12-13H,8-11,14H2,1H3,(H,23,27)

InChI Key

MKUMPVQUCCOOJD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19980486

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.39

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.245

Distribution Coefficient, logD

4.245

Water Solubility, LogSw

-4.18

Polar Surface Area

41.389

Acid Dissociation Constant (pKa)

12.15

Base Dissociation Constant (pKb)

0.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

V029-2515 in Drug Discovery

Included in Screening Libraries

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with V029-2515 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-2515?
Check Price and Availability of V029-2515, 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 V029-2515 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-2515
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-2515
  • 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 V029-2515 available by request