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CAS 1416990-10-7 2,6-Piperidinedione, 3-(1,3-dihydro-7-hydroxy-1-oxo-2H-isoindol-2-yl)- molecular structure lightbox
CAS RN: 1416990-10-7

2,6-Piperidinedione, 3-(1,3-dihydro-7-hydroxy-1-oxo-2H-isoindol-2-yl)-

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260107 100mg / 250mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: SSC-052288
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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: ＞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 1416990-10-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Shanghai Inquiry

1416990-10-7 / 3-(4-hydroxy-3-oxo-1H-isoindol-2-yl)piperidine-2,6-dione

Standard CAS: 1416990-10-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1416990-10-7
Multi CAS
No
Molecular Formula
C13H12N2O4
Molecular Weight
260.240000
Exact Mass
260.079707
SMILES
C1CC(=O)NC(=O)C1N2CC3=C(C2=O)C(=CC=C3)O
InChI
InChI=1S/C13H12N2O4/c16-9-3-1-2-7-6-15(13(19)11(7)9)8-4-5-10(17)14-12(8)18/h1-3,8,16H,4-6H2,(H,14,17,18)
InChIKey
ZHINEOZMGPJDNM-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
19
Aromatic heavy atom count
6
Fraction Csp3
0.31
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
2
Molar refractivity
64.15
TPSA
86.71

LogP / Solubility

WLOGP
0.15
MLOGP
0.14
XLogP3
0.4
Consensus LogP
0.23
Log S (ESOL)
-1.72
Class (ESOL)
Soluble
Log S (Ali)
-1.8
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.6
Class (SILICOS-IT)
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)
-4.2

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2

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