3651-6244 Screening compound: 2-(4-butylphenyl)-3-{[(3,4-dimethoxyphenyl)methyl]amino}-3,4-dihydroquinazolin-4-one

3651-6244 Screening compound: 2-(4-butylphenyl)-3-{[(3,4-dimethoxyphenyl)methyl]amino}-3,4-dihydroquinazolin-4-one
3651-6244 Screening compound: 2-(4-butylphenyl)-3-{[(3,4-dimethoxyphenyl)methyl]amino}-3,4-dihydroquinazolin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3651-6244
2-(4-butylphenyl)-3-{[(3,4-dimethoxyphenyl)methyl]amino}-3,4-dihydroquinazolin-4-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

3651-6244

Molecular Formula

C27H29N3O3 (C27 H29 N3 O3)

Compound Name

2-(4-butylphenyl)-3-{[(3,4-dimethoxyphenyl)methyl]amino}-3,4-dihydroquinazolin-4-one

IUPAC name

2-(4-butylphenyl)-3-{[(34-dimethoxyphenyl)methyl]amino}-34-dihydroquinazolin-4-one

SMILES

CCCCc(cc1)ccc1C(N1NCc(cc2)cc(OC)c2OC)=Nc(cccc2)c2C1=O

InChI

InChI=1S/C27H29N3O3/c1-4-5-8-19-11-14-21(15-12-19)26-29-23-10-7-6-9-22(23)27(31)30(26)28-18-20-13-16-24(32-2)25(17-20)33-3/h6-7,9-17,28H,4-5,8,18H2,1-3H3

InChI Key

SNRSJYURRZRSFP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02643569

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.55

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.657

Distribution Coefficient, logD

4.657

Water Solubility, LogSw

-4.46

Polar Surface Area

54.137

Acid Dissociation Constant (pKa)

26.33

Base Dissociation Constant (pKb)

3.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.90

3651-6244 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with 3651-6244 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3651-6244?
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What is the minimum amount of 3651-6244 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3651-6244
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3651-6244
  • 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 3651-6244 available by request