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CAS 1078150-17-0 2-bromo-6,7-dihydrothieno[3,2-c]pyridin-4(5H)-one molecular structure lightbox
CAS RN: 1078150-17-0

2-bromo-6,7-dihydrothieno[3,2-c]pyridin-4(5H)-one

Product Availability

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5 package records4 with current stock2 grade groups
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251025 100mg In stock Inquiry
Batchno.20260523 1g In stock Inquiry
Batchno.20250519 250mg In stock Inquiry
Batchno.20260403 50mg In stock Inquiry
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260410 50mg / 250mg Out of stock 8-10 business days Inquiry
  • Product code: SSC-009185
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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 1078150-17-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Shenzhen Inquiry

1078150-17-0 / 2-bromo-6,7-dihydro-5H-thieno[3,2-c]pyridin-4-one

2-bromo-4H,5H,6H,7H-thieno[3,2-c]pyridin-4-one | 2-bromo-4H,5H,6H,7H-thieno(3,2-c)pyridin-4-one | RefChem:466640

Standard CAS: 1078150-17-0 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1078150-17-0
Multi CAS
No
Molecular Formula
C7H6BrNOS
Molecular Weight
232.100000
Exact Mass
230.935350
SMILES
C1CNC(=O)C2=C1SC(=C2)Br
InChI
InChI=1S/C7H6BrNOS/c8-6-3-4-5(11-6)1-2-9-7(4)10/h3H,1-2H2,(H,9,10)
InChIKey
LFAFLPSPMUUPIX-UHFFFAOYSA-N
Synonyms
2-bromo-4H,5H,6H,7H-thieno[3,2-c]pyridin-4-one 2-bromo-4H,5H,6H,7H-thieno(3,2-c)pyridin-4-one RefChem:466640 874-895-9 2-BROMO-6,7-DIHYDROTHIENO[3,2-C]PYRIDIN-4(5H)-ONE

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
5
Fraction Csp3
0.29
H-bond acceptors
2
H-bond donors
1
Molar refractivity
48.06
TPSA
29.1

LogP / Solubility

WLOGP
1.8
MLOGP
1.58
XLogP3
2
Consensus LogP
1.79
Log S (ESOL)
-2.75
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.76
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.66
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)
-2.86

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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