Basic information
- CAS
253446-15-0- Standard SMILES
Br.Oc1cc2c(c(Cl)c1O)CCNC[C@@H]2c1ccccc1- InChIKey
RMIJGBMRNYUZRG-BTQNPOSSSA-N- Molecular formula
- C16H17BrClNO2
- Average molar mass
- 370.7 g/mol
- Monoisotopic mass
- 369.01312
Names & identifiers
- Preferred name
- R(+)-SKF-81297 hydrobromide
- IUPAC
- (5R)-9-chloro-5-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol;hydrobromide
- English name
- R(+)-SKF-81297 hydrobromide selective d1 dopamine
- Molecular formula
- C16H16ClNO2.BrH
- Molecular weight
- 370.672
Names & synonyms
R(+)-SKF-81297 hydrobromide253446-15-0J494DH8JRCSKF-81297 hydrobromide, (R)-1H-3-Benzazepine-7,8-diol, 6-chloro-2,3,4,5-tetrahydro-1-phenyl-, hydrobromide, (1R)-(R)-SKF-81297 (hydrobromide)SKF81297 (hydrobromide);SKF-81297(hydrobromide)UNII-J494DH8JRCorb2664039SCHEMBL7664990CHEMBL1257026DTXSID3058743
Show more names
R(+)-SKF-81297R(+)-SKF-81297 hydrobromide selective d1 dopamine(5R)-9-chloro-5-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol
(R)-SKF 81297 hydrobromideHY-12236BBS162625T89498R(+)-SKF-81297 hydrobromide, >=98% (HPLC), solid(5R)-9-chloro-5-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol;hydrobromide(R)-6-chloro-1-phenyl-2,3,4,5-tetrahydro-1H-benzo[d]azepine-7,8-diolhydrobromide(1R)-6-Chloro-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol--hydrogen bromide (1/1)
Database identifiers
- CAS
253446-15-0- PubChem CID
- 16219952
- DTXSID
DTXSID3058743
Properties
Computed structural properties
- Topological polar surface area
- 52.5 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 322
Physicochemical properties
- solubility
- 2 O: · H2O: soluble6mg/mL
- form
- solid
- color
- white to off-white
- optical activity
- 22 · [α]22/D +15.14°, c = 0.52 in DMF(lit.)
- Water Solubility
- 2 O: · H2O: 6mg/mLDMSO: soluble
- InChI
- 1S/C16H16ClNO2.BrH/c17-15-11-6-7-18-9-13(10-4-2-1-3-5-10)12(11)8-14(19)16(15)20;/h1-5,8,13,18-20H,6-7,9H2;1H/t13-;/m1./s1
- InChIKey
- RMIJGBMRNYUZRG-BTQNPOSSSA-N
- SMILES
- Br[H].Oc1cc2[C@H](CNCCc2c(Cl)c1O)c3ccccc3
- FDA UNII
- 494 DH8JRC · J494DH8JRC
- UNSPSC Code
- 12352200 · 12352200
- NACRES
- 77 · NA.77
- PPE
- 95 · Eyeshields, Gloves, type N95 (US)
- WGK Germany
- 3 · 3
- Storage Class
- 11 · 11 - Combustible Solids
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
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- 3
- Storage Class
- 11 - Combustible Solids
Chemistry & industry
Applications
UsesR(+)-SKF-81297 Hydrobromide is a dopamine D1 agonist.
UsesR(+)-SKF-81297 hydrobromide has used as D1-type dopamine receptor agonist: to test it effect on the spike firing in rat retinal ganglion cellsin human embryonic kidney (HEK) 293T cellsto test its inhibitory effect in microglial cells
Suppliers4 total
上海安化生物技术有限公司021-61263375 18168859245
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
无锡迈默拓普生物科技有限公司15061806929 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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