T992-1418 Screening compound: 1-[(3,5-DIMETHOXYPHENYL)METHYL]-4-[5-METHYL-2-(PROPAN-2-YL)-1,3-OXAZOLE-4-CARBONYL]PIPERAZINE

T992-1418 Screening compound: 1-[(3,5-DIMETHOXYPHENYL)METHYL]-4-[5-METHYL-2-(PROPAN-2-YL)-1,3-OXAZOLE-4-CARBONYL]PIPERAZINE
T992-1418 Screening compound: 1-[(3,5-DIMETHOXYPHENYL)METHYL]-4-[5-METHYL-2-(PROPAN-2-YL)-1,3-OXAZOLE-4-CARBONYL]PIPERAZINE alternative view

Chemical Structure Depiction of ChemDiv screening compound T992-1418
1-[(3,5-DIMETHOXYPHENYL)METHYL]-4-[5-METHYL-2-(PROPAN-2-YL)-1,3-OXAZOLE-4-CARBONYL]PIPERAZINE

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

T992-1418

Molecular Formula

C21H29N3O4 (C21 H29 N3 O4)

Compound Name

1-[(3,5-DIMETHOXYPHENYL)METHYL]-4-[5-METHYL-2-(PROPAN-2-YL)-1,3-OXAZOLE-4-CARBONYL]PIPERAZINE

IUPAC name

n/a

SMILES

CC(C)c1nc(C(N2CCN(Cc3cc(OC)cc(OC)c3)CC2)=O)c(C)o1

InChI

InChI=1S/C21H29N3O4/c1-14(2)20-22-19(15(3)28-20)21(25)24-8-6-23(7-9-24)13-16-10-17(26-4)12-18(11-16)27-5/h10-12,14H,6-9,13H2,1-5H3

InChI Key

JGKBGBIOGDJHLI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29029113

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

387.48

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.950

Distribution Coefficient, logD

1.478

Water Solubility, LogSw

-2.99

Polar Surface Area

53.413

Acid Dissociation Constant (pKa)

27.39

Base Dissociation Constant (pKb)

8.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.40

T992-1418 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with T992-1418 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T992-1418?
Check Price and Availability of T992-1418, 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 T992-1418 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T992-1418
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T992-1418
  • 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 T992-1418 available by request