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CAS 83777-91-7 5H-Indeno[5,6-d]thiazol-2-amine,6,7-dihydro-(9CI) molecular structure lightbox
CAS RN: 83777-91-7

5H-Indeno[5,6-d]thiazol-2-amine,6,7-dihydro-(9CI)

  • Product code: SSC-191481
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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 83777-91-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Shanghai Inquiry

83777-91-7 / 6,7-dihydro-5H-cyclopenta[f][1,3]benzothiazol-2-amine

Standard CAS: 83777-91-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
83777-91-7
Multi CAS
No
Molecular Formula
C10H10N2S
Molecular Weight
190.270000
Exact Mass
190.056470
InChI
InChI=1S/C10H10N2S/c11-10-12-8-4-6-2-1-3-7(6)5-9(8)13-10/h4-5H,1-3H2,(H2,11,12)
InChIKey
MPVRQOFISAAHEX-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
9
Fraction Csp3
0.3
H-bond acceptors
3
H-bond donors
1
Molar refractivity
56.06
TPSA
38.91

LogP / Solubility

WLOGP
2.37
MLOGP
2.08
XLogP3
2.9
Consensus LogP
2.45
Log S (ESOL)
-3.02
Class (ESOL)
Poorly soluble
Log S (Ali)
-2.83
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.86
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.2

Drug-likeness / Medicinal Chemistry

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

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