Basic information
- CAS
113403-10-4- Standard SMILES
CC(C)Cc1ccc([C@H](C)C(=O)O)cc1.NCCCC[C@H](N)C(=O)O- InChIKey
IHHXIUAEPKVVII-PTKYJSHISA-N- Molecular formula
- C19H32N2O4
- Average molar mass
- 352.5 g/mol
- Monoisotopic mass
- 352.23620751
Names & identifiers
- Preferred name
- Dexibuprofen lysine anhydrous
- IUPAC
- (2S)-2,6-diaminohexanoic acid;(2S)-2-[4-(2-methylpropyl)phenyl]propanoic acid
- English name
- Dexibuprofen lysine (innm)
- Molecular formula
- C19H32N2O4
- Molecular weight
- 352.46838
Names & synonyms
Dexibuprofen lysine anhydrous(S)-(+)-Ibuprofen (S)-(+)-LysinateB5VWM9PYNC(2S)-2,6-diaminohexanoic acid;(2S)-2-[4-(2-methylpropyl)phenyl]propanoic acidL-lysine 2-(4-isobutylphenyl)propanoic acid salt[(5S)-5-Amino-5-carboxypentyl]azanium;(2S)-2-[4-(2-methylpropyl)phenyl]propanoateUNII-B5VWM9PYNCS(+)-Ibuprofen L-Lysine(S)-ibuprofen (S)-lysineorb1986138SCHEMBL8733957DTXSID70150405
Show more names
DoctrinL669455L-669455L 669455L-669,455DEXIBUPROFEN lysinateIbuprofen Impurity 42Dexibuprofen lysine (innm)(2s)-2-(4-isobutylphenyl)propanoic acid - l-lysine hydrate (1:1:1)
IHHXIUAEPKVVII-PTKYJSHISA-N(+/-)-(S)-p-Isobutylhydratropic acid, compound with L-lysine (1:1)AKOS040751537T31398Q27274409(2S)-2-[4-(2-Methylpropyl)phenyl]propanoic acid--L-lysine (1/1)(+)-(S)-P-ISOBUTYLHYDRATROPIC ACID, COMPOUND WITH L-LYSINE (1:1)
Database identifiers
Properties
Computed structural properties
- Topological polar surface area
- 127 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 309
Physicochemical properties
- solubility
- soluble in Methanol, Water
- form
- Solid
- color
- Off-White to Light Yellow
- FDA UNII
- 5 VWM9PYNC · B5VWM9PYNC
Chemistry & industry
Suppliers18 total
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
武汉贝乐叶生物医药科技有限公司15871353653 18086118076 · [email protected]
上海明褀化学有限公司86-21-60936353
凯试（上海）科技有限公司021-50135380 · [email protected]
武汉贝乐叶生物医药科技有限公司18086118078 · [email protected]
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
艾吉析科技（上海）有限公司17721401538;17717235263 17721401538 · [email protected]
湖南瑞威尔生物科技有限公司18502762003
南京罗迈美生物科技有限公司[email protected]
武汉研哲科技有限公司15527250409 · [email protected]
河南天孚化工有限公司+86-0371-55170693 +86-19937530512 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
Related reactions
2 records
Compound notes
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