V020-4439 Screening compound: 2-[(4-tert-butyl-1,3-thiazol-2-yl)(4-methoxyphenyl)amino]-1-(pyrrolidin-1-yl)butan-1-one

V020-4439 Screening compound: 2-[(4-tert-butyl-1,3-thiazol-2-yl)(4-methoxyphenyl)amino]-1-(pyrrolidin-1-yl)butan-1-one
V020-4439 Screening compound: 2-[(4-tert-butyl-1,3-thiazol-2-yl)(4-methoxyphenyl)amino]-1-(pyrrolidin-1-yl)butan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-4439
2-[(4-tert-butyl-1,3-thiazol-2-yl)(4-methoxyphenyl)amino]-1-(pyrrolidin-1-yl)butan-1-one

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

V020-4439

Molecular Formula

C22H31N3O2S (C22 H31 N3 O2 S)

Compound Name

2-[(4-tert-butyl-1,3-thiazol-2-yl)(4-methoxyphenyl)amino]-1-(pyrrolidin-1-yl)butan-1-one

IUPAC name

2-[(4-tert-butyl-13-thiazol-2-yl)(4-methoxyphenyl)amino]-1-(pyrrolidin-1-yl)butan-1-one

SMILES

CCC(C(N1CCCC1)=O)N(c1nc(C(C)(C)C)cs1)c(cc1)ccc1OC

InChI

InChI=1S/C22H31N3O2S/c1-6-18(20(26)24-13-7-8-14-24)25(16-9-11-17(27-5)12-10-16)21-23-19(15-28-21)22(2,3)4/h9-12,15,18H,6-8,13-14H2,1-5H3/t18-/m0/s1

InChI Key

WTIYYFOWWAOJAY-SFHVURJKSA-N

MDL Number (MFCD)

MFCD19793563

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

401.57

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.524

Distribution Coefficient, logD

5.515

Water Solubility, LogSw

-5.28

Polar Surface Area

36.100

Acid Dissociation Constant (pKa)

15.13

Base Dissociation Constant (pKb)

5.72

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

54.50

References: we are preparing a list of scientific research reports with V020-4439 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-4439?
Check Price and Availability of V020-4439, 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 V020-4439 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-4439
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-4439
  • 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 V020-4439 available by request