8018-3182 Screening compound: 3-(3,4-dimethoxybenzoyl)-1,2-bis(propane-1-sulfonyl)-7-(pyridin-4-yl)indolizine

8018-3182 Screening compound: 3-(3,4-dimethoxybenzoyl)-1,2-bis(propane-1-sulfonyl)-7-(pyridin-4-yl)indolizine
8018-3182 Screening compound: 3-(3,4-dimethoxybenzoyl)-1,2-bis(propane-1-sulfonyl)-7-(pyridin-4-yl)indolizine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-3182
3-(3,4-dimethoxybenzoyl)-1,2-bis(propane-1-sulfonyl)-7-(pyridin-4-yl)indolizine

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

8018-3182

Molecular Formula

C28H30N2O7S2 (C28 H30 N2 O7 S2)

Compound Name

3-(3,4-dimethoxybenzoyl)-1,2-bis(propane-1-sulfonyl)-7-(pyridin-4-yl)indolizine

IUPAC name

3-(34-dimethoxybenzoyl)-12-bis(propane-1-sulfonyl)-7-(pyridin-4-yl)indolizine

SMILES

CCCS(c1c(cc(cc2)-c3ccncc3)n2c(C(c(cc2)cc(OC)c2OC)=O)c1S(CCC)(=O)=O)(=O)=O

InChI

InChI=1S/C28H30N2O7S2/c1-5-15-38(32,33)27-22-17-20(19-9-12-29-13-10-19)11-14-30(22)25(28(27)39(34,35)16-6-2)26(31)21-7-8-23(36-3)24(18-21)37-4/h7-14,17-18H,5-6,15-16H2,1-4H3

InChI Key

XNQWZWSZIAYAKW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01199183

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

570.69

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.300

Distribution Coefficient, logD

3.294

Water Solubility, LogSw

-3.56

Polar Surface Area

94.654

Acid Dissociation Constant (pKa)

21.51

Base Dissociation Constant (pKb)

5.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

References: we are preparing a list of scientific research reports with 8018-3182 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-3182?
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What is the minimum amount of 8018-3182 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-3182
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-3182
  • 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 8018-3182 available by request