Screening compound: C21H22BrClF3N5O (6049-2101)

Screening compound: C<sub>21</sub>H<sub>22</sub>BrClF<sub>3</sub>N<sub>5</sub>O (6049-2101)
Screening compound: C<sub>21</sub>H<sub>22</sub>BrClF<sub>3</sub>N<sub>5</sub>O (6049-2101) alternative view

Chemical Structure Depiction of ChemDiv screening compound
C21H22BrClF3N5O (6049-2101)

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

6049-2101

Molecular Formula

C21H22BrClF3N5O (C21 H22 BrClF3 N5 O)

Compound Name

5-(4-bromophenyl)-3-chloro-2-{octahydropyrrolo[1,2-a]pyrazine-2-carbonyl}-7-(trifluoromethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine

IUPAC name

5-(4-bromophenyl)-3-chloro-2-{octahydropyrrolo[12-a]pyrazine-2-carbonyl}-7-(trifluoromethyl)-4H5H6H7H-pyrazolo[15-a]pyrimidine

SMILES

O=C(c1nn(C(CC(c(cc2)ccc2Br)N2)C(F)(F)F)c2c1Cl)N1CC(CCC2)N2CC1

InChI

InChI=1S/C21H22BrClF3N5O/c22-13-5-3-12(4-6-13)15-10-16(21(24,25)26)31-19(27-15)17(23)18(28-31)20(32)30-9-8-29-7-1-2-14(29)11-30/h3-6,14-16,27H,1-2,7-11H2

InChI Key

UTDNFSHITUPIRW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02055724

C21H22BrClF3N5O (6049-2101) in Drug Discovery

Included in Screening Libraries

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

CNS BBB Library (22607 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with C21H22BrClF3N5O (6049-2101) chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C21H22BrClF3N5O (6049-2101)?
Check Price and Availability of C21H22BrClF3N5O (6049-2101), 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 C21H22BrClF3N5O (6049-2101) you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C21H22BrClF3N5O (6049-2101)
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C21H22BrClF3N5O (6049-2101)
  • 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 C21H22BrClF3N5O (6049-2101) available by request