D347-2636 Screening compound: 4-[1-(2-{2-methoxy-4-[(1E)-prop-1-en-1-yl]phenoxy}ethyl)-1H-1,3-benzodiazol-2-yl]-1-(4-methylphenyl)pyrrolidin-2-one

D347-2636 Screening compound: 4-[1-(2-{2-methoxy-4-[(1E)-prop-1-en-1-yl]phenoxy}ethyl)-1H-1,3-benzodiazol-2-yl]-1-(4-methylphenyl)pyrrolidin-2-one
D347-2636 Screening compound: 4-[1-(2-{2-methoxy-4-[(1E)-prop-1-en-1-yl]phenoxy}ethyl)-1H-1,3-benzodiazol-2-yl]-1-(4-methylphenyl)pyrrolidin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D347-2636
4-[1-(2-{2-methoxy-4-[(1E)-prop-1-en-1-yl]phenoxy}ethyl)-1H-1,3-benzodiazol-2-yl]-1-(4-methylphenyl)pyrrolidin-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

D347-2636

Molecular Formula

C30H31N3O3 (C30 H31 N3 O3)

Compound Name

4-[1-(2-{2-methoxy-4-[(1E)-prop-1-en-1-yl]phenoxy}ethyl)-1H-1,3-benzodiazol-2-yl]-1-(4-methylphenyl)pyrrolidin-2-one

IUPAC name

4-[1-(2-{2-methoxy-4-[(1E)-prop-1-en-1-yl]phenoxy}ethyl)-1H-13-benzodiazol-2-yl]-1-(4-methylphenyl)pyrrolidin-2-one

SMILES

C/C=C/c(cc1)cc(OC)c1OCCn1c(cccc2)c2nc1C(CC1=O)CN1c1ccc(C)cc1

InChI

InChI=1S/C30H31N3O3/c1-4-7-22-12-15-27(28(18-22)35-3)36-17-16-32-26-9-6-5-8-25(26)31-30(32)23-19-29(34)33(20-23)24-13-10-21(2)11-14-24/h4-15,18,23H,16-17,19-20H2,1-3H3/t23-/m1/s1

InChI Key

RFJAGCGJSVXRSQ-HSZRJFAPSA-N

MDL Number (MFCD)

MFCD09759510

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

481.59

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.303

Distribution Coefficient, logD

6.303

Water Solubility, LogSw

-5.41

Polar Surface Area

41.759

Acid Dissociation Constant (pKa)

11.48

Base Dissociation Constant (pKb)

1.37

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.70

References: we are preparing a list of scientific research reports with D347-2636 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D347-2636?
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What is the minimum amount of D347-2636 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D347-2636
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D347-2636
  • 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 D347-2636 available by request