Screening compound: XNBRNBLIRNIPCZ-UHFFFAOYSA-N

Screening compound: XNBRNBLIRNIPCZ-UHFFFAOYSA-N
Screening compound: XNBRNBLIRNIPCZ-UHFFFAOYSA-N alternative view

Chemical Structure Depiction of ChemDiv screening compound
XNBRNBLIRNIPCZ-UHFFFAOYSA-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

V003-6726

Molecular Formula

C29H31ClFN3O6S (C29 H31 ClFN3 O6 S)

Compound Name

2-{3-[4-(2-chloro-5-fluorobenzoyl)piperazin-1-yl]-4-methoxybenzenesulfonyl}-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline

IUPAC name

2-{3-[4-(2-chloro-5-fluorobenzoyl)piperazin-1-yl]-4-methoxybenzenesulfonyl}-67-dimethoxy-1234-tetrahydroisoquinoline

SMILES

COc(ccc(S(N(CC1)Cc(cc2OC)c1cc2OC)(=O)=O)c1)c1N(CC1)CCN1C(c(cc(cc1)F)c1Cl)=O

InChI

InChI=1S/C29H31ClFN3O6S/c1-38-26-7-5-22(41(36,37)34-9-8-19-14-27(39-2)28(40-3)15-20(19)18-34)17-25(26)32-10-12-33(13-11-32)29(35)23-16-21(31)4-6-24(23)30/h4-7,14-17H,8-13,18H2,1-3H3

InChI Key

XNBRNBLIRNIPCZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19950822

XNBRNBLIRNIPCZ-UHFFFAOYSA-N in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

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

Frequently Asked Questions

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