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CAS 24410-19-3 PYRIDO[2,3-D]PYRIMIDIN-4(1H)-ONE molecular structure lightbox
CAS RN: 24410-19-3

PYRIDO[2,3-D]PYRIMIDIN-4(1H)-ONE

  • Product code: SSC-118807
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 5g
  • Available purity: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 24410-19-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Shanghai Inquiry

24410-19-3 / 4aH-pyrido[2,3-d]pyrimidin-4-one

Standard CAS: 24410-19-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
24410-19-3
Multi CAS
No
Molecular Formula
C7H5N3O
Molecular Weight
147.130000
Exact Mass
147.043262
SMILES
C1=CC2C(=NC=NC2=O)N=C1
InChI
InChI=1S/C7H5N3O/c11-7-5-2-1-3-8-6(5)9-4-10-7/h1-5H
InChIKey
SOKBSHYEHIOGDF-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
0.14
H-bond acceptors
3
Molar refractivity
42.06
TPSA
54.15

LogP / Solubility

WLOGP
0.21
MLOGP
0.18
XLogP3
-0.5
Consensus LogP
-0.04
Log S (ESOL)
-0.88
Class (ESOL)
Very soluble
Log S (Ali)
-0.92
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.79
Class (SILICOS-IT)
Very soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.47

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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