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CAS 305371-18-0 4-chloro-6-fluoro-1,7- molecular structure lightbox
CAS RN: 305371-18-0

4-chloro-6-fluoro-1,7-

  • Product code: SSC-135166
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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: 0.25g
  • 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 305371-18-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Hong Kong Inquiry

305371-18-0 / 4-chloro-6-fluoro-1,7-naphthyridine-3-carbonitrile

Standard CAS: 305371-18-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
305371-18-0
Multi CAS
No
Molecular Formula
C9H3CLFN3
Molecular Weight
207.590000
Exact Mass
206.999953
InChI
InChI=1S/C9H3ClFN3/c10-9-5(2-12)3-13-7-4-14-8(11)1-6(7)9/h1,3-4H
InChIKey
XJFIAYNKSIJCTA-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
10
H-bond acceptors
3
Molar refractivity
49.22
TPSA
49.57

LogP / Solubility

WLOGP
2.29
MLOGP
2.02
XLogP3
1.9
Consensus LogP
2.07
Log S (ESOL)
-3.1
Class (ESOL)
Poorly soluble
Log S (Ali)
-2.92
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)
-2.36

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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