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CAS 835616-62-1 1H-Isoindole-1,3(2H)-dione, 5-chloro-2-(2,6-dioxo-3-piperidinyl)- molecular structure lightbox
CAS RN: 835616-62-1

1H-Isoindole-1,3(2H)-dione, 5-chloro-2-(2,6-dioxo-3-piperidinyl)-

Product Availability

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4 package records4 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260428 1g / 5g / 25g Confirm by inquiry Shandong Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250409 1g In stock Shanghai Inquiry
Batchno.20260119 250mg In stock Shanghai Inquiry
Batchno.20260226 5g In stock Shanghai Inquiry
  • Product code: SSC-191342
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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: ≥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 835616-62-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Hong Kong Inquiry

835616-62-1 / 5-chloro-2-(2,6-dioxopiperidin-3-yl)isoindole-1,3-dione

Standard CAS: 835616-62-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
835616-62-1
Multi CAS
No
Molecular Formula
C13H9CLN2O4
Molecular Weight
292.670000
Exact Mass
292.025085
InChI
InChI=1S/C13H9ClN2O4/c14-6-1-2-7-8(5-6)13(20)16(12(7)19)9-3-4-10(17)15-11(9)18/h1-2,5,9H,3-4H2,(H,15,17,18)
InChIKey
FQMXCKFRJZTKSB-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
20
Aromatic heavy atom count
6
Fraction Csp3
0.23
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
1
Molar refractivity
68.12
TPSA
83.55

LogP / Solubility

WLOGP
0.74
MLOGP
0.66
XLogP3
1
Consensus LogP
0.8
Log S (ESOL)
-2.28
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.5
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.3
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.98

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2

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