5655-0163 Screening compound: 2-imino-1-isopropyl-5-oxo-N~3~-(tetrahydro-2-furanylmethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide

5655-0163 Screening compound: 2-imino-1-isopropyl-5-oxo-N~3~-(tetrahydro-2-furanylmethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide
5655-0163 Screening compound: 2-imino-1-isopropyl-5-oxo-N~3~-(tetrahydro-2-furanylmethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5655-0163
2-imino-1-isopropyl-5-oxo-N~3~-(tetrahydro-2-furanylmethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide

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

5655-0163

Molecular Formula

C20H23N5O3 (C20 H23 N5 O3)

Compound Name

2-imino-1-isopropyl-5-oxo-N~3~-(tetrahydro-2-furanylmethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide

IUPAC name

6-imino-2-oxo-N-[(oxolan-2-yl)methyl]-7-(propan-2-yl)-179-triazatricyclo[8.4.0.0^{38}]tetradeca-3(8)491113-pentaene-5-carboxamide

SMILES

CC(C)N(C(C(C(NCC1OCCC1)=O)=C1)=N)C(N=C2N3C=CC=C2)=C1C3=O

InChI

InChI=1S/C20H23N5O3/c1-12(2)25-17(21)14(19(26)22-11-13-6-5-9-28-13)10-15-18(25)23-16-7-3-4-8-24(16)20(15)27/h3-4,7-8,10,12-13,21H,5-6,9,11H2,1-2H3,(H,22,26)/t13-/m1/s1

InChI Key

CWLJMSYRSSACCW-CYBMUJFWSA-N

MDL Number (MFCD)

MFCD03528956

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.43

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.367

Distribution Coefficient, logD

0.327

Water Solubility, LogSw

-1.15

Polar Surface Area

77.329

Acid Dissociation Constant (pKa)

9.53

Base Dissociation Constant (pKb)

6.35

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

References: we are preparing a list of scientific research reports with 5655-0163 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5655-0163?
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What is the minimum amount of 5655-0163 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5655-0163
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5655-0163
  • 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 5655-0163 available by request