8020-7238 Screening compound: 4-(3,4-dimethoxybenzoyl)-3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-5-(7-methoxy-1,3-benzodioxol-5-yl)-1,5-dihydro-2H-pyrrol-2-one

8020-7238 Screening compound: 4-(3,4-dimethoxybenzoyl)-3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-5-(7-methoxy-1,3-benzodioxol-5-yl)-1,5-dihydro-2H-pyrrol-2-one
8020-7238 Screening compound: 4-(3,4-dimethoxybenzoyl)-3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-5-(7-methoxy-1,3-benzodioxol-5-yl)-1,5-dihydro-2H-pyrrol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8020-7238
4-(3,4-dimethoxybenzoyl)-3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-5-(7-methoxy-1,3-benzodioxol-5-yl)-1,5-dihydro-2H-pyrrol-2-one

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

8020-7238

Molecular Formula

C27H27N3O8 (C27 H27 N3 O8)

Compound Name

4-(3,4-dimethoxybenzoyl)-3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-5-(7-methoxy-1,3-benzodioxol-5-yl)-1,5-dihydro-2H-pyrrol-2-one

IUPAC name

4-(34-dimethoxybenzoyl)-3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-5-(7-methoxy-2H-13-benzodioxol-5-yl)-25-dihydro-1H-pyrrol-2-one

SMILES

COc1c2OCOc2cc(C(C(C(c(cc2)cc(OC)c2OC)=O)=C2O)N(CCCn3cncc3)C2=O)c1

InChI

InChI=1S/C27H27N3O8/c1-34-18-6-5-16(11-19(18)35-2)24(31)22-23(17-12-20(36-3)26-21(13-17)37-15-38-26)30(27(33)25(22)32)9-4-8-29-10-7-28-14-29/h5-7,10-14,23,32H,4,8-9,15H2,1-3H3/t23-/m0/s1

InChI Key

SXJFQHBZMNWZPH-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD26098821

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

521.53

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

2.054

Distribution Coefficient, logD

1.811

Water Solubility, LogSw

-2.59

Polar Surface Area

97.297

Acid Dissociation Constant (pKa)

9.97

Base Dissociation Constant (pKb)

7.27

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.63

References: we are preparing a list of scientific research reports with 8020-7238 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8020-7238?
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What is the minimum amount of 8020-7238 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8020-7238
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8020-7238
  • 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 8020-7238 available by request