2-[2,4-bis(tert-pentyl)phenoxy]-N-[4-[4,5-dihydro-5-oxo-3-(pyrrolidin-1-yl)-1H-pyrazol-1-yl]phenyl]-4-[(1-phenyl-1H-tetrazol-5-yl)thio]butyramide monohydrochloride (CAS 63059-50-7) — formula C40H50N8O3S.ClH, molecular weight 759.4; category organic chemicals.
| CAS Number | 63059-50-7 |
|---|---|
| Molecular Formula | C40H50N8O3S.ClH |
| Molecular Weight | 759.4 |
| Applications | General Manufacturing Information: Butanamide, 2-[2, 4-bis(1, 1-dimethylpropyl)phenoxy]-N-[4-[4, 5-dihydro-5-oxo-4-[(1-phenyl-1H-tetrazol-5-yl)thio]-3-(1-pyrrolidinyl)-1H-pyrazol-1-yl]phenyl]-, hydrochloride (1:1): INACTIVE |
| Category | Organic Chemicals |
Documented applications: General Manufacturing Information: Butanamide, 2-[2, 4-bis(1, 1-dimethylpropyl)phenoxy]-N-[4-[4, 5-dihydro-5-oxo-4-[(1-phenyl-1H-tetrazol-5-yl)thio]-3-(1-pyrrolidinyl)-1H-pyrazol-1-yl]phenyl]-, hydrochloride (1:1): INACTIVE.
2-[2,4-bis(tert-pentyl)phenoxy]-N-[4-[4,5-dihydro-5-oxo-3-(pyrrolidin-1-yl)-1H-pyrazol-1-yl]phenyl]-4-[(1-phenyl-1H-tetrazol-5-yl)thio]butyramide monohydrochloride is a carbon-based organic compound with CAS registry number 63059-50-7 and molecular formula C40H50N8O3S.ClH (molecular weight 759.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 63059-50-7
Its molecular formula C40H50N8O3S.ClH comprises 40 C, 51 H, 8 N, 3 O, 1 S, 1 Cl atoms.
Also known as: 2-[2,4-bis(tert-pentyl)phenoxy]-N-[4-[4,5-dihydro-5-oxo-3-(pyrrolidin-1-yl)-1H-pyrazol-1-yl]phenyl]-4-[(1-phenyl-1H-tetrazol-5-yl)thio]butyramide monohydrochloride · 2-[2,4-双(叔戊基)苯氧基]-N-[4-[4,5-二氢-5-氧代-3-(吡咯烷-1-基)-1H-吡唑-1-基]苯基]-4-[(1-苯基-1H-四唑-5-基)硫代]丁酰胺单盐酸盐
Category: organic chemicals
The CAS registry number of 2-[2,4-bis(tert-pentyl)phenoxy]-N-[4-[4,5-dihydro-5-oxo-3-(pyrrolidin-1-yl)-1H-pyrazol-1-yl]phenyl]-4-[(1-phenyl-1H-tetrazol-5-yl)thio]butyramide monohydrochloride is 63059-50-7.
Molecular formula C40H50N8O3S.ClH, molecular weight 759.4.
It is also registered under: 2-[2,4-bis(tert-pentyl)phenoxy]-N-[4-[4,5-dihydro-5-oxo-3-(pyrrolidin-1-yl)-1H-pyrazol-1-yl]phenyl]-4-[(1-phenyl-1H-tetrazol-5-yl)thio]butyramide monohydrochloride, 2-[2,4-双(叔戊基)苯氧基]-N-[4-[4,5-二氢-5-氧代-3-(吡咯烷-1-基)-1H-吡唑-1-基]苯基]-4-[(1-苯基-1H-四唑-5-基)硫代]丁酰胺单盐酸盐.
Recorded applications: General Manufacturing Information: Butanamide, 2-[2, 4-bis(1, 1-dimethylpropyl)phenoxy]-N-[4-[4, 5-dihydro-5-oxo-4-[(1-phenyl-1H-tetrazol-5-yl)thio]-3-(1-pyrrolidinyl)-1H-pyrazol-1-yl]phenyl]-, hydrochloride (1:1): INACTIVE.
Category: Organic Chemicals.
Independent reference data for 2-[2,4-bis(tert-pentyl)phenoxy]-N-[4-[4,5-dihydro-5-oxo-3-(pyrrolidin-1-yl)-1H-pyrazol-1-yl]phenyl]-4-[(1-phenyl-1H-tetrazol-5-yl)thio]butyramide monohydrochloride (CAS 63059-50-7), compiled from public chemistry databases.
| CAS 号 | 63059-50-7 |
|---|---|
| PubChem CID | 162990 |
| 分子式 | C40H50N8O3S.ClH |
| IUPAC 名称 | 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-[4-[5-oxo-4-(1-phenyltetrazol-5-yl)sulfanyl-3-pyrrolidin-1-yl-4H-pyrazol-1-yl]phenyl]butanamide;hydrochloride |
| Molecular Weight | 759.4 |
|---|---|
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 14 |
| Exact Mass | 758.3493364 |
| Monoisotopic Mass | 758.3493364 |
| Topological Polar Surface Area | 143 |
| Heavy Atom Count | 53 |
EINECS 263-822-0; 63059-50-7; DTXSID60886529; RefChem:121989; DTXCID801025853; MSZZAZVGVLVBBO-UHFFFAOYSA-N
2-[2,4-双(叔戊基)苯氧基]-N-[4-[4,5-二氢-5-氧代-3-(吡咯烷-1-基)-1H-吡唑-1-基]苯基]-4-[(1-苯基-1H-四唑-5-基)硫代]丁酰胺单盐酸盐 · CAS 63059-50-7 · C40H50N8O3S.ClH.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 2-[2,4-双(叔戊基)苯氧基]-N-[4-[4,5-二氢-5-氧代-3-(吡咯烷-1-基)-1H-吡唑-1-基]苯基]-4-[(1-苯基-1H-四唑-5-基)硫代]丁酰胺单盐酸盐