V029-7117 Screening compound: N-[4-(dimethylamino)-3-{[2-methoxy-N-(2-methylpropyl)acetamido]methyl}phenyl]-3-methylbutanamide

V029-7117 Screening compound: N-[4-(dimethylamino)-3-{[2-methoxy-N-(2-methylpropyl)acetamido]methyl}phenyl]-3-methylbutanamide
V029-7117 Screening compound: N-[4-(dimethylamino)-3-{[2-methoxy-N-(2-methylpropyl)acetamido]methyl}phenyl]-3-methylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-7117
N-[4-(dimethylamino)-3-{[2-methoxy-N-(2-methylpropyl)acetamido]methyl}phenyl]-3-methylbutanamide

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

V029-7117

Molecular Formula

C21H35N3O3 (C21 H35 N3 O3)

Compound Name

N-[4-(dimethylamino)-3-{[2-methoxy-N-(2-methylpropyl)acetamido]methyl}phenyl]-3-methylbutanamide

IUPAC name

N-[4-(dimethylamino)-3-{[2-methoxy-N-(2-methylpropyl)acetamido]methyl}phenyl]-3-methylbutanamide

SMILES

CC(C)CC(Nc(cc1)cc(CN(CC(C)C)C(COC)=O)c1N(C)C)=O

InChI

InChI=1S/C21H35N3O3/c1-15(2)10-20(25)22-18-8-9-19(23(5)6)17(11-18)13-24(12-16(3)4)21(26)14-27-7/h8-9,11,15-16H,10,12-14H2,1-7H3,(H,22,25)

InChI Key

WYIQUZVKHJTDGE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19799851

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

377.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.290

Distribution Coefficient, logD

3.288

Water Solubility, LogSw

-3.59

Polar Surface Area

50.271

Acid Dissociation Constant (pKa)

12.07

Base Dissociation Constant (pKb)

8.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

61.90

V029-7117 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 V029-7117 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-7117?
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What is the minimum amount of V029-7117 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-7117
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-7117
  • 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 V029-7117 available by request