CAS RN: 1053655-63-2
Methyl 2-bromo-5-chloro-1,3-thiazole-4-carboxylate
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250728 | 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-007099
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: ＞97%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 5g | ＞97% | 0 Out of Stock | Hong Kong | Inquiry |
1053655-63-2 / methyl 2-bromo-5-chloro-1,3-thiazole-4-carboxylate
Methyl 2-bromo-5-chloro-1,3-thiazole-4-carboxylate | DTXSID90653281 | RefChem:814209
Basic Information
CAS
1053655-63-2
Multi CAS
No
Molecular Formula
C5H3BrClNO2S
Molecular Weight
256.510000
Exact Mass
254.875640
SMILES
COC(=O)C1=C(SC(=N1)Br)Cl
InChI
InChI=1S/C5H3BrClNO2S/c1-10-4(9)2-3(7)11-5(6)8-2/h1H3
InChIKey
LUGAGMHCJHFNFH-UHFFFAOYSA-N
Synonyms
Methyl 2-bromo-5-chloro-1,3-thiazole-4-carboxylate
DTXSID90653281
RefChem:814209
DTXCID90604031
814-875-9
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
5
Fraction Csp3
0.2
Rotatable bonds
1
H-bond acceptors
4
Molar refractivity
46.16
TPSA
39.19
LogP / Solubility
WLOGP
2.35
MLOGP
2.07
XLogP3
3.1
Consensus LogP
2.51
Log S (ESOL)
-3.18
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.36
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.39
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
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.62
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
1.5
Safety & Transport
Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement Codes
P264, P270, P301+P317, P330, and P501
Customers Also Viewed
-
![CAS 1053655-66-5 7-Bromo[1,2,4]triazolo[1,5-a]pyridine molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
-
[1,2,4]Triazolo[1,5-a]pyridine-5-carboxylic acid methyl ester
- CAS RN: 1053655-68-7
- Product Code: SSC-007101
-
-
3-broMo-5-Methoxy-1H-pyrrolo[2,3-b]pyridine
- CAS RN: 1053655-76-7
- Product Code: SSC-007103
-
3-broMo-4-Methoxy-1H-pyrrolo[2,3-b]pyridine
- CAS RN: 1053655-78-9
- Product Code: SSC-007104
-
![CAS 1053655-66-5 7-Bromo[1,2,4]triazolo[1,5-a]pyridine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1053655-66-5.gif)
![CAS 1053655-68-7 [1,2,4]Triazolo[1,5-a]pyridine-5-carboxylic acid methyl ester molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1053655-68-7.gif)
![CAS 1053655-76-7 3-broMo-5-Methoxy-1H-pyrrolo[2,3-b]pyridine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1053655-76-7.gif)
![CAS 1053655-78-9 3-broMo-4-Methoxy-1H-pyrrolo[2,3-b]pyridine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1053655-78-9.gif)
