Simeprevir (CAS 923604-59-5) — formula C38H47N5O7S2, molecular weight 749.9; category organic chemicals.
Simeprevir (CAS 923604-59-5) is a chemical raw material in the organic chemicals category. Its molecular formula C38H47N5O7S2 comprises 38 C, 47 H, 5 N, 7 O, 2 S atoms. Its molecular weight is about 749.9. Reported physicochemical data: melting point around 225, LogP about 4.8. As a sourcing and distribution partner we help locate and compare this item across domestic and cross-border channels, arranging samples and batch orders with full COA and compliance files.
| CAS Number | 923604-59-5 |
|---|---|
| Molecular Formula | C38H47N5O7S2 |
| Molecular Weight | 749.9 |
| Melting Point | 225 |
| LogP | 4.8 |
| Applications | Treatment of chronic hepatitis, Antiviral Agents, Protease Inhibitors, MEDICATON, Formulations/Preparations: Oral: Capsules 150 mg simeprevir (as simeprevir sodium), Galexos (Janssen) |
| Category | Organic Chemicals |
Documented applications: Treatment of chronic hepatitis, Antiviral Agents, Protease Inhibitors, MEDICATON, Formulations/Preparations: Oral: Capsules 150 mg simeprevir (as simeprevir sodium), Galexos (Janssen).
Simeprevir is a carbon-based organic compound with CAS registry number 923604-59-5 and molecular formula C38H47N5O7S2 (molecular weight 749.9), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 923604-59-5
Its molecular formula C38H47N5O7S2 comprises 38 C, 47 H, 5 N, 7 O, 2 S atoms.
Also known as: Simeprevir · 西美瑞韦
Category: organic chemicals
The CAS registry number of Simeprevir is 923604-59-5.
Molecular formula C38H47N5O7S2, molecular weight 749.9.
It is also registered under: Simeprevir, 西美瑞韦.
Recorded applications: Treatment of chronic hepatitis, Antiviral Agents, Protease Inhibitors, MEDICATON, Formulations/Preparations: Oral: Capsules 150 mg simeprevir (as simeprevir sodium), Galexos (Janssen).
Category: Organic Chemicals.
Packaging is agreed per order, from lab-scale packs to bulk, and confirmed with each order rather than fixed on the page. A Certificate of Analysis (COA) ships with every batch and MSDS is available; where the end use carries a regulatory limit (food contact, pharmaceutical or cosmetic), state the standard at enquiry and the grade is set against it.
Independent reference data for Simeprevir (CAS 923604-59-5), compiled from public chemistry databases.
| CAS Registry Number | 923604-59-5 |
|---|---|
| PubChem CID | 24873435 |
| Molecular formula | C38H47N5O7S2 |
| IUPAC name | (1R,4R,6S,7Z,15R,17R)-N-cyclopropylsulfonyl-17-[7-methoxy-8-methyl-2-(4-propan-2-yl-1,3-thiazol-2-yl)quinolin-4-yl]oxy-13-methyl-2,14-dioxo-3,13-diazatricyclo[13.3.0.04,6]octadec-7-ene-4-carboxamide |
| UNII (FDA) | 9WS5RD66HZ |
| Molecular Weight | 749.9 |
|---|---|
| XLogP3 | 4.8 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 10 |
| Rotatable Bond Count | 8 |
| Exact Mass | 749.29169120 |
| Monoisotopic Mass | 749.29169120 |
| Topological Polar Surface Area | 194 |
| Heavy Atom Count | 52 |
| Melting Point | 225 |
|---|
SIMEPREVIR; 923604-59-5; TMC435350; TMC-435; TMC 435; TMC435; TMC 435350; TMC-435350; DTXSID20919221; 9WS5RD66HZ; simeprevirum; 435, TMC; 435350, TMC; RefChem:183072; J05AP05; DTXCID001510258
| Reported hazard statements | H302 (50%), H319 (100%), H362 (50%), H410 (50%), H413 (50%) |
|---|
H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Simeprevir · CAS 923604-59-5 · C38H47N5O7S2. UNII 9WS5RD66HZ. Melting Point: 225.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 西美瑞韦