V011-6101 Screening compound: 3,3-dimethyl-N-{4-[5-(2-methylphenyl)-3-(propan-2-yloxy)-1H-1,2,4-triazol-1-yl]phenyl}butanamide

V011-6101 Screening compound: 3,3-dimethyl-N-{4-[5-(2-methylphenyl)-3-(propan-2-yloxy)-1H-1,2,4-triazol-1-yl]phenyl}butanamide
V011-6101 Screening compound: 3,3-dimethyl-N-{4-[5-(2-methylphenyl)-3-(propan-2-yloxy)-1H-1,2,4-triazol-1-yl]phenyl}butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-6101
3,3-dimethyl-N-{4-[5-(2-methylphenyl)-3-(propan-2-yloxy)-1H-1,2,4-triazol-1-yl]phenyl}butanamide

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

V011-6101

Molecular Formula

C24H30N4O2 (C24 H30 N4 O2)

Compound Name

3,3-dimethyl-N-{4-[5-(2-methylphenyl)-3-(propan-2-yloxy)-1H-1,2,4-triazol-1-yl]phenyl}butanamide

IUPAC name

33-dimethyl-N-{4-[5-(2-methylphenyl)-3-(propan-2-yloxy)-1H-124-triazol-1-yl]phenyl}butanamide

SMILES

CC(C)Oc(nc1-c2c(C)cccc2)nn1-c(cc1)ccc1NC(CC(C)(C)C)=O

InChI

InChI=1S/C24H30N4O2/c1-16(2)30-23-26-22(20-10-8-7-9-17(20)3)28(27-23)19-13-11-18(12-14-19)25-21(29)15-24(4,5)6/h7-14,16H,15H2,1-6H3,(H,25,29)

InChI Key

RVBVDGOYQKNIIB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19758069

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

406.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.779

Distribution Coefficient, logD

5.779

Water Solubility, LogSw

-5.52

Polar Surface Area

53.642

Acid Dissociation Constant (pKa)

12.00

Base Dissociation Constant (pKb)

0.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

References: we are preparing a list of scientific research reports with V011-6101 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-6101?
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What is the minimum amount of V011-6101 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-6101
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-6101
  • 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 V011-6101 available by request