Basic information
- CAS
54-84-2- Standard SMILES
CN(C)CCCSc1ccccc1NC(=O)C=Cc1ccccc1.Cl- InChIKey
LXGJPDKYMJJWRB-UHFFFAOYSA-N- Molecular formula
- C20H25ClN2OS
- Average molar mass
- 376.9 g/mol
- Monoisotopic mass
- 376.1376123
Names & identifiers
- Preferred name
- 2'-(3-Dimethylaminopropyl-thio)-cinnamanilide
- IUPAC
- N-[2-[3-(dimethylamino)propylsulfanyl]phenyl]-3-phenylprop-2-enamide;hydrochloride
- English name
- Cinanserin hydrochloride
- Molecular formula
- C20H25ClN2OS
- Molecular weight
- 376.95
Names & synonyms
SCHEMBL121120N-[2-([3-(Dimethylamino)propyl]thio)phenyl]-3-phenyl-2-propenamideorb1308451LXGJPDKYMJJWRB-UHFFFAOYSA-ND806152'-(3-DIMETHYLAMINOPROPYL-THIO)-CINNAMANILIDE2'-(3-dimethylaminopropylthio) cinnamanilide hydrochloride2'-(3-Dimethylaminopropylthio)cinnamanilide, hydrochlorideN-[2-[3-(dimethylamino)propylsulfanyl]phenyl]-3-phenyl-prop-2-enamide;hydrochlorideDPTCmaptcsq10,643
Show more names
Nsc125717CINANSERINCinnanserinDPTC HYDROCHLORIDECinanserin hydrochlorideCinanserin hydrochloride, 10 mM in DMSO2'-(3-DIMETHYLAMINOPROPYL-THIO)-CINNAMANILIDE HYDROCHLORIDE
Database identifiers
- CAS
54-84-2- PubChem CID
- 5912
Properties
Computed structural properties
- Topological polar surface area
- 57.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 391
Physicochemical properties
- Density
- 1.22 g/cm3 · 1.22 g/cm3
- storage temp.
- -20 °C · Inert atmosphere,Store in freezer, under -20°C
- solubility
- 125 mg/mL · DMSO : 125 mg/mL (331.62 mM; Need ultrasonic)
- form
- Powder
- color
- Light yellow to yellow
- Water Solubility
- 50 mM · Soluble to 50 mM in water
- FDA UNII
- 65 Z32KI62 · F65Z32KI62
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
- HS Code
- 2921490090 · 2921490090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2921490090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Applications
UsesSerotonin inhibitor.
Suppliers28 total
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
北京华美互利生物化工010-56205725 · [email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
湖北科乐精细化工有限公司027-59101668 19945030958 · [email protected]
Aladdin Scientific[email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
Qingdao Dexin Chemical Co., Ltd+86-15553333686 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
开封明仁药业有限公司0371-65741762 · [email protected]
南通全益生物科技有限公司0513-66337626 18051384581 · [email protected]
Related reactions
1 records
Compound notes
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