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CAS 67092-17-5 2(1H)-Quinazolinone, 5,6-dichloro- molecular structure lightbox
CAS RN: 67092-17-5

2(1H)-Quinazolinone, 5,6-dichloro-

  • Product code: SSC-176738
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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: 1g
  • Available purity: ≥95%
  • 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 67092-17-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

67092-17-5 / 5,6-dichloro-1H-quinazolin-2-one

Standard CAS: 67092-17-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
67092-17-5
Multi CAS
No
Molecular Formula
C8H4CL2N2O
Molecular Weight
215.030000
Exact Mass
213.970068
InChI
InChI=1S/C8H4Cl2N2O/c9-5-1-2-6-4(7(5)10)3-11-8(13)12-6/h1-3H,(H,11,12,13)
InChIKey
OXLCJCBYCLWUFO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
10
H-bond acceptors
2
H-bond donors
1
Molar refractivity
52.38
TPSA
45.75

LogP / Solubility

WLOGP
2.23
MLOGP
1.96
XLogP3
2
Consensus LogP
2.06
Log S (ESOL)
-3.15
Class (ESOL)
Poorly soluble
Log S (Ali)
-2.93
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.91
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.45

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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