Screening compound: XHMQPHABRHVGTE-YQVWRLOYSA-N

Screening compound: XHMQPHABRHVGTE-YQVWRLOYSA-N
Screening compound: XHMQPHABRHVGTE-YQVWRLOYSA-N alternative view

Chemical Structure Depiction of ChemDiv screening compound
XHMQPHABRHVGTE-YQVWRLOYSA-N

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

N119-0141

Molecular Formula

C21H32N6O4S (C21 H32 N6 O4 S)

Compound Name

(1R,2R,9S)-11-({4-[(1-ethyl-1H-pyrazol-4-yl)sulfonyl]piperazino}carbonyl)-7,11-diazatricyclo[7.3.1.0~2,7~]tridecan-6-one

IUPAC name

(1R2R9S)-11-{4-[(1-ethyl-1H-pyrazol-4-yl)sulfonyl]piperazine-1-carbonyl}-711-diazatricyclo[7.3.1.0^{27}]tridecan-6-one

SMILES

CCn1ncc(S(N(CC2)CCN2C(N(C[C@@H](C2)C3)C[C@@H]2[C@@H](CCC2)N3C2=O)=O)(=O)=O)c1

InChI

InChI=1S/C21H32N6O4S/c1-2-25-15-18(11-22-25)32(30,31)26-8-6-23(7-9-26)21(29)24-12-16-10-17(14-24)19-4-3-5-20(28)27(19)13-16/h11,15-17,19H,2-10,12-14H2,1H3/t16-,17+,19+/m0/s1

InChI Key

XHMQPHABRHVGTE-YQVWRLOYSA-N

MDL Number (MFCD)

XHMQPHABRHVGTE-YQVWRLOYSA-N in Drug Discovery

Included in Screening Libraries

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

CNS MPO Library (28609 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

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

Frequently Asked Questions

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