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CAS 1048358-33-3 N-Boc-2-amino-5-bromo[1,3,4]thiadiazole molecular structure lightbox
CAS RN: 1048358-33-3

N-Boc-2-amino-5-bromo[1,3,4]thiadiazole

Product Availability

Choose a grade to view its available package options.

7 package records6 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250206 1g / 5g Out of stock 8-10 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250116 100g In stock Shanghai Inquiry
Batchno.20250604 100mg In stock Shanghai, Shenzhen, Wuhan Inquiry
Batchno.20260530 1g In stock Shanghai, Tianjin Inquiry
Batchno.20250419 250mg In stock Shanghai, Tianjin, Wuhan Inquiry
Batchno.20250610 25g In stock Shanghai, Shenzhen, Wuhan, Chengdu Inquiry
Batchno.20250803 5g In stock Shanghai, Shenzhen, Tianjin Inquiry
  • Product code: SSC-006560
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 1g, 25g, 5g, 10g, 0.1g, 0.25g, 100g
  • Available purity: >97%
  • Inventory rows with stock: 6
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1048358-33-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >97% 5 In Stock Beijing Inquiry
25g >97% 5 In Stock Shenzhen Inquiry
5g >97% 4 In Stock Hong Kong Inquiry
10g >97% 3 In Stock Beijing Inquiry
0.1g >97% 1 In Stock Beijing Inquiry
0.25g >97% 1 In Stock Shanghai Inquiry
100g >97% 0 Out of Stock Hong Kong Inquiry

1048358-33-3 / tert-butyl N-(5-bromo-1,3,4-thiadiazol-2-yl)carbamate

N-Boc-2-Amino-5-bromo[1,3,4]thiadiazole | tert-butyl N-(5-bromo-1,3,4-thiadiazol-2-yl)carbamate | MFCD11848382

Standard CAS: 1048358-33-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
1048358-33-3
Multi CAS
Yes
Molecular Formula
C7H10BrN3O2S
Molecular Weight
280.140000
Exact Mass
278.967710
SMILES
CC(C)(C)OC(=O)NC1=NN=C(S1)Br
InChI
InChI=1S/C7H10BrN3O2S/c1-7(2,3)13-6(12)9-5-11-10-4(8)14-5/h1-3H3,(H,9,11,12)
InChIKey
FVENMKPZBGIYPA-UHFFFAOYSA-N
Synonyms
N-Boc-2-Amino-5-bromo[1,3,4]thiadiazole tert-butyl N-(5-bromo-1,3,4-thiadiazol-2-yl)carbamate MFCD11848382 tert-butyl (5-bromo-1,3,4-thiadiazol-2-yl)carbamate SCHEMBL18834722

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
5
Fraction Csp3
0.57
Rotatable bonds
1
H-bond acceptors
5
H-bond donors
1
Molar refractivity
57.47
TPSA
64.11

LogP / Solubility

WLOGP
2.65
MLOGP
2.34
XLogP3
2.3
Consensus LogP
2.43
Log S (ESOL)
-3.44
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.77
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.8
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.55

Drug-likeness / Medicinal Chemistry

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

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