7571-0930 Screening compound: N-(2-methoxyphenyl)-2-{[2-(4-methoxyphenyl)-7,7-dimethyl-5H,7H,8H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}propanamide

7571-0930 Screening compound: N-(2-methoxyphenyl)-2-{[2-(4-methoxyphenyl)-7,7-dimethyl-5H,7H,8H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}propanamide
7571-0930 Screening compound: N-(2-methoxyphenyl)-2-{[2-(4-methoxyphenyl)-7,7-dimethyl-5H,7H,8H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 7571-0930
N-(2-methoxyphenyl)-2-{[2-(4-methoxyphenyl)-7,7-dimethyl-5H,7H,8H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}propanamide

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

7571-0930

Molecular Formula

C26H29N3O4S (C26 H29 N3 O4 S)

Compound Name

N-(2-methoxyphenyl)-2-{[2-(4-methoxyphenyl)-7,7-dimethyl-5H,7H,8H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}propanamide

IUPAC name

N-(2-methoxyphenyl)-2-{[2-(4-methoxyphenyl)-77-dimethyl-5H7H8H-pyrano[43-d]pyrimidin-4-yl]sulfanyl}propanamide

SMILES

CC(C(Nc(cccc1)c1OC)=O)Sc1nc(-c(cc2)ccc2OC)nc2c1COC(C)(C)C2

InChI

InChI=1S/C26H29N3O4S/c1-16(24(30)28-20-8-6-7-9-22(20)32-5)34-25-19-15-33-26(2,3)14-21(19)27-23(29-25)17-10-12-18(31-4)13-11-17/h6-13,16H,14-15H2,1-5H3,(H,28,30)/t16-/m0/s1

InChI Key

SPHLDVJBMTUOPD-INIZCTEOSA-N

MDL Number (MFCD)

MFCD04016405

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

479.6

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.132

Distribution Coefficient, logD

6.132

Water Solubility, LogSw

-5.61

Polar Surface Area

65.356

Acid Dissociation Constant (pKa)

11.05

Base Dissociation Constant (pKb)

3.83

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

34.60

7571-0930 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 7571-0930 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7571-0930?
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What is the minimum amount of 7571-0930 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7571-0930
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7571-0930
  • 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 7571-0930 available by request