V001-4092 Screening compound: N-(butan-2-yl)-N-{[2-(dimethylamino)-5-(2-methoxyacetamido)phenyl]methyl}-2-ethylbutanamide

V001-4092 Screening compound: N-(butan-2-yl)-N-{[2-(dimethylamino)-5-(2-methoxyacetamido)phenyl]methyl}-2-ethylbutanamide
V001-4092 Screening compound: N-(butan-2-yl)-N-{[2-(dimethylamino)-5-(2-methoxyacetamido)phenyl]methyl}-2-ethylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V001-4092
N-(butan-2-yl)-N-{[2-(dimethylamino)-5-(2-methoxyacetamido)phenyl]methyl}-2-ethylbutanamide

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

V001-4092

Molecular Formula

C22H37N3O3 (C22 H37 N3 O3)

Compound Name

N-(butan-2-yl)-N-{[2-(dimethylamino)-5-(2-methoxyacetamido)phenyl]methyl}-2-ethylbutanamide

IUPAC name

N-(butan-2-yl)-N-{[2-(dimethylamino)-5-(2-methoxyacetamido)phenyl]methyl}-2-ethylbutanamide

SMILES

CCC(C)N(Cc(cc(cc1)NC(COC)=O)c1N(C)C)C(C(CC)CC)=O

InChI

InChI=1S/C22H37N3O3/c1-8-16(4)25(22(27)17(9-2)10-3)14-18-13-19(23-21(26)15-28-7)11-12-20(18)24(5)6/h11-13,16-17H,8-10,14-15H2,1-7H3,(H,23,26)/t16-/m0/s1

InChI Key

KBAORKOFJZMFEN-INIZCTEOSA-N

MDL Number (MFCD)

MFCD19808616

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

391.55

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.213

Distribution Coefficient, logD

4.211

Water Solubility, LogSw

-4.27

Polar Surface Area

50.126

Acid Dissociation Constant (pKa)

12.51

Base Dissociation Constant (pKb)

8.13

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

63.60

V001-4092 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with V001-4092 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V001-4092?
Check Price and Availability of V001-4092, 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 V001-4092 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V001-4092
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V001-4092
  • 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 V001-4092 available by request