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CAS 1239015-83-8 (S)-2-benzyl-2,3-dihydrobenzo[d]imidazo[2,1-b]thiazole molecular structure lightbox
CAS RN: 1239015-83-8

(S)-2-benzyl-2,3-dihydrobenzo[d]imidazo[2,1-b]thiazole

Product Availability

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3 package records2 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250322 100mg In stock Shanghai Inquiry
Batchno.20251031 1g Out of stock Inquiry
Batchno.20250328 250mg In stock Shanghai Inquiry
  • Product code: SSC-027531
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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 1239015-83-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Shenzhen Inquiry

1239015-83-8 / (2S)-2-benzyl-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole

Standard CAS: 1239015-83-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1239015-83-8
Multi CAS
No
Molecular Formula
C16H14N2S
Molecular Weight
266.400000
Exact Mass
266.087770
SMILES
C1[C@@H](N=C2N1C3=CC=CC=C3S2)CC4=CC=CC=C4
InChI
InChI=1S/C16H14N2S/c1-2-6-12(7-3-1)10-13-11-18-14-8-4-5-9-15(14)19-16(18)17-13/h1-9,13H,10-11H2/t13-/m0/s1
InChIKey
QYOVGGRICFJFEJ-ZDUSSCGKSA-N

Computed Properties

Structural Parameters

Heavy atom count
19
Aromatic heavy atom count
12
Fraction Csp3
0.19
Rotatable bonds
2
H-bond acceptors
3
Molar refractivity
81.01
TPSA
15.6

LogP / Solubility

WLOGP
3.58
MLOGP
3.16
XLogP3
3.5
Consensus LogP
3.41
Log S (ESOL)
-4.08
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.33
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.6
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.8

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5

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