![CAS 1799610-91-5 Thieno[2,3-d]pyrimidine, 4-chloro-5,6-diiodo- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1799610-91-5.gif)
CAS RN: 1799610-91-5
Thieno[2,3-d]pyrimidine, 4-chloro-5,6-diiodo-
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.20260507 | 100mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-080307
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: >95%
- 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.
1799610-91-5 / 4-chloro-5,6-diiodothieno[2,3-d]pyrimidine
Basic Information
CAS
1799610-91-5
Multi CAS
No
Molecular Formula
C6HClI2N2S
Molecular Weight
422.410000
Exact Mass
421.763840
SMILES
C1=NC2=C(C(=C(S2)I)I)C(=N1)Cl
InChI
InChI=1S/C6HClI2N2S/c7-4-2-3(8)5(9)12-6(2)11-1-10-4/h1H
InChIKey
MQEJJHPRNBGTMM-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
9
H-bond acceptors
3
Molar refractivity
67.86
TPSA
25.78
LogP / Solubility
WLOGP
3.55
MLOGP
3.15
XLogP3
3.9
Consensus LogP
3.53
Log S (ESOL)
-5.25
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.59
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.36
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.77
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
Applications of CAS 1799610-91-5
This compound is commonly used in general chemistry research and laboratory applications. Starshine Chemical supplies CAS 1799610-91-5 for R&D and pilot-scale use, with flexible pack sizes and purity grades available.
Storage & Handling
Storage: Keep the container tightly closed in a cool, dry and well-ventilated place. For detailed hazard, storage and transport information, request the SDS (Safety Data Sheet) with your inquiry.
Quotation & Packaging
Prices are confirmed by inquiry. Request a quote for current pricing, minimum order quantity (MOQ) and lead time. The pack sizes listed on this page are reference options; custom pack sizes and bulk quantities are available on request.
Quality & Compliance
Specifications and purity shown on this page are based on batch records. A Certificate of Analysis (COA) is available on request. For research and further manufacturing use only — not for direct human or therapeutic use.
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