KETO ITRACONAZOLE (CAS 112560-33-5) — formula C35H36Cl2N8O5, molecular weight 719.6; category organic chemicals.
| CAS Number | 112560-33-5 |
|---|---|
| Molecular Formula | C35H36Cl2N8O5 |
| Molecular Weight | 719.6 |
| LogP | 4.5 |
| Category | Organic Chemicals |
KETO ITRACONAZOLE is a carbon-based organic compound with CAS registry number 112560-33-5 and molecular formula C35H36Cl2N8O5 (molecular weight 719.6), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 112560-33-5
Its molecular formula C35H36Cl2N8O5 comprises 35 C, 36 H, 2 Cl, 8 N, 5 O atoms.
Also known as: KETO ITRACONAZOLE · 酮类伊曲康唑
Category: organic chemicals
The CAS registry number of KETO ITRACONAZOLE is 112560-33-5.
Molecular formula C35H36Cl2N8O5, molecular weight 719.6.
It is also registered under: KETO ITRACONAZOLE, 酮类伊曲康唑.
Category: Organic Chemicals.
Independent reference data for KETO ITRACONAZOLE (CAS 112560-33-5), compiled from public chemistry databases.
| CAS Registry Number | 112560-33-5 |
|---|---|
| PubChem CID | 45039625 |
| Molecular formula | C35H36Cl2N8O5 |
| IUPAC name | 4-[4-[4-[4-[[(2R,4S)-2-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]phenyl]-2-(3-oxobutan-2-yl)-1,2,4-triazol-3-one |
| Molecular Weight | 719.6 |
|---|---|
| XLogP3 | 4.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 10 |
| Rotatable Bond Count | 11 |
| Exact Mass | 718.2185717 |
| Monoisotopic Mass | 718.2185717 |
| Topological Polar Surface Area | 118 |
| Heavy Atom Count | 50 |
Keto Itraconazole; 112560-33-5; Itraconazole 2-Oxo Metabolite; C35H36Cl2N8O5; orb1696772; DTXSID00662046; CHEBI:143461; MFCD08063772; AKOS025394153; HY-117789; T32389
KETO ITRACONAZOLE · CAS 112560-33-5 · C35H36Cl2N8O5.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 酮类伊曲康唑