8018-7241 Screening compound: 1,4-bis[2,5-dimethoxy-4-(1H-1,2,3,4-tetrazol-1-yl)benzenesulfonyl]-1,4-diazepane

8018-7241 Screening compound: 1,4-bis[2,5-dimethoxy-4-(1H-1,2,3,4-tetrazol-1-yl)benzenesulfonyl]-1,4-diazepane
8018-7241 Screening compound: 1,4-bis[2,5-dimethoxy-4-(1H-1,2,3,4-tetrazol-1-yl)benzenesulfonyl]-1,4-diazepane alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-7241
1,4-bis[2,5-dimethoxy-4-(1H-1,2,3,4-tetrazol-1-yl)benzenesulfonyl]-1,4-diazepane

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

8018-7241

Molecular Formula

C23H28N10O8S2 (C23 H28 N10 O8 S2)

Compound Name

1,4-bis[2,5-dimethoxy-4-(1H-1,2,3,4-tetrazol-1-yl)benzenesulfonyl]-1,4-diazepane

IUPAC name

14-bis[25-dimethoxy-4-(1H-1234-tetrazol-1-yl)benzenesulfonyl]-14-diazepane

SMILES

COc(c(-n1nnnc1)c1)cc(S(N(CCC2)CCN2S(c(cc(c(-n2nnnc2)c2)OC)c2OC)(=O)=O)(=O)=O)c1OC

InChI

InChI=1S/C23H28N10O8S2/c1-38-18-12-22(20(40-3)10-16(18)32-14-24-26-28-32)42(34,35)30-6-5-7-31(9-8-30)43(36,37)23-13-19(39-2)17(11-21(23)41-4)33-15-25-27-29-33/h10-15H,5-9H2,1-4H3

InChI Key

VWBJEXAKMODMCP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08142745

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

636.67

Hydrogen Bond Acceptors Count

20.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

18

Partition Coefficient, logP

1.316

Distribution Coefficient, logD

1.316

Water Solubility, LogSw

-1.85

Polar Surface Area

173.250

Acid Dissociation Constant (pKa)

27.38

Base Dissociation Constant (pKb)

-1.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

References: we are preparing a list of scientific research reports with 8018-7241 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-7241?
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What is the minimum amount of 8018-7241 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-7241
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-7241
  • 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 8018-7241 available by request