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CAS 955406-11-8 (4,5,6,7-Tetrahydro-2H-indazol-5-yl)-carbaMic acid tert-butyl ester molecular structure lightbox
CAS RN: 955406-11-8

(4,5,6,7-Tetrahydro-2H-indazol-5-yl)-carbaMic acid tert-butyl ester

Product Availability

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5 package records0 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20260222 100mg Out of stock Inquiry
Batchno.20250907 10g Out of stock Inquiry
Batchno.20250509 1g Out of stock Inquiry
Batchno.20250830 250mg Out of stock Inquiry
Batchno.20251112 5g Out of stock Inquiry
  • Product code: SSC-211018
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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 955406-11-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Hong Kong Inquiry

955406-11-8 / tert-butyl N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)carbamate

Standard CAS: 955406-11-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
955406-11-8
Multi CAS
No
Molecular Formula
C12H19N3O2
Molecular Weight
237.300000
Exact Mass
237.147727
InChI
InChI=1S/C12H19N3O2/c1-12(2,3)17-11(16)14-9-4-5-10-8(6-9)7-13-15-10/h7,9H,4-6H2,1-3H3,(H,13,15)(H,14,16)
InChIKey
PMIXNXQUMXCCIK-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
17
Aromatic heavy atom count
5
Fraction Csp3
0.67
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
2
Molar refractivity
63.77
TPSA
67.01

LogP / Solubility

WLOGP
1.79
MLOGP
1.58
XLogP3
1.7
Consensus LogP
1.69
Log S (ESOL)
-2.59
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.8
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.81
Class (SILICOS-IT)
Moderately 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)
-2.9

Drug-likeness / Medicinal Chemistry

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

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