CAS RN: 1015591-57-7
Methyl 4-chlorothiazole-5-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.20250614 | 100mg / 250mg | Out of stock | 5-7 business days | Inquiry |
- Product code: SSC-002378
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: 0.1g, 0.25g, 1g, 5g
- Available purity: >97%
- Inventory rows with stock: 4
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
1015591-57-7 / methyl 4-chloro-1,3-thiazole-5-carboxylate
Methyl 4-chlorothiazole-5-carboxylate | methyl 4-chloro-1,3-thiazole-5-carboxylate | MFCD10478283
Basic Information
CAS
1015591-57-7
Multi CAS
No
Molecular Formula
C5H4ClNO2S
Molecular Weight
177.610000
Exact Mass
176.965127
SMILES
COC(=O)C1=C(N=CS1)Cl
InChI
InChI=1S/C5H4ClNO2S/c1-9-5(8)3-4(6)7-2-10-3/h2H,1H3
InChIKey
CFFMCXJJYDGJCF-UHFFFAOYSA-N
Synonyms
Methyl 4-chlorothiazole-5-carboxylate
methyl 4-chloro-1,3-thiazole-5-carboxylate
MFCD10478283
SCHEMBL20138768
QQB59157
Computed Properties
Structural Parameters
Heavy atom count
10
Aromatic heavy atom count
5
Fraction Csp3
0.2
Rotatable bonds
1
H-bond acceptors
4
Molar refractivity
38.46
TPSA
39.19
LogP / Solubility
WLOGP
1.58
MLOGP
1.39
XLogP3
2.1
Consensus LogP
1.69
Log S (ESOL)
-2.24
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.16
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.25
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)
-2.68
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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