8015-6244 Screening compound: ethyl 4-(2,5-dimethylphenyl)-2-oxo-6-[(pyrrolidin-1-yl)methyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate

8015-6244 Screening compound: ethyl 4-(2,5-dimethylphenyl)-2-oxo-6-[(pyrrolidin-1-yl)methyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
8015-6244 Screening compound: ethyl 4-(2,5-dimethylphenyl)-2-oxo-6-[(pyrrolidin-1-yl)methyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8015-6244
ethyl 4-(2,5-dimethylphenyl)-2-oxo-6-[(pyrrolidin-1-yl)methyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate

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

8015-6244

Molecular Formula

C20H27N3O3 (C20 H27 N3 O3)

Compound Name

ethyl 4-(2,5-dimethylphenyl)-2-oxo-6-[(pyrrolidin-1-yl)methyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate

IUPAC name

ethyl 4-(25-dimethylphenyl)-2-oxo-6-[(pyrrolidin-1-yl)methyl]-1234-tetrahydropyrimidine-5-carboxylate

SMILES

CCOC(C(C(c1c(C)ccc(C)c1)N1)=C(CN2CCCC2)NC1=O)=O

InChI

InChI=1S/C20H27N3O3/c1-4-26-19(24)17-16(12-23-9-5-6-10-23)21-20(25)22-18(17)15-11-13(2)7-8-14(15)3/h7-8,11,18H,4-6,9-10,12H2,1-3H3,(H2,21,22,25)/t18-/m1/s1

InChI Key

RPJDMOITEINOJV-GOSISDBHSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.45

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.805

Distribution Coefficient, logD

2.805

Water Solubility, LogSw

-2.91

Polar Surface Area

61.151

Acid Dissociation Constant (pKa)

6.55

Base Dissociation Constant (pKb)

12.11

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with 8015-6244 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8015-6244?
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What is the minimum amount of 8015-6244 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8015-6244
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8015-6244
  • 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 8015-6244 available by request