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2-(1-Hydroxyethyl) Promazine-d4

CAT: 0572-TRC-H942297-2.5MGSize: 2.5 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-H942297-2.5MGSize:2.5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1346603-20-0
Synonyms
10-[3-(Dimethylamino)propyl]-α-methyl-10H-phenothiazine-2-methanol-d4;
Hazard Statement
Harmful if swallowed.
Purity
>95% (HPLC)
Smiles
[2H]C(O)(C([2H])([2H])[2H])C(C=C1)=CC2=C1SC3=CC=CC=C3N2CCCN(C)C
Molecular Formula
C19H20D4N2OS
Molecular Weight
332.5
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

2-(1-Hydroxyethyl) Promazine-d4
CAS Number1346603-20-0
PubChem CID71749045
IUPAC Name1,2,2,2-tetradeuterio-1-[10-[3-(dimethylamino)propyl]phenothiazin-2-yl]ethanol
Molecular FormulaC19H24N2OS
Molecular Weight332.5
XLogP3.8
Topological Polar Surface Area52
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count23
Formal Charge0
Complexity378
SMILES
[2H]C([2H])([2H])C([2H])(C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN(C)C)O
InChI
InChI=1S/C19H24N2OS/c1-14(22)15-9-10-19-17(13-15)21(12-6-11-20(2)3)16-7-4-5-8-18(16)23-19/h4-5,7-10,13-14,22H,6,11-12H2,1-3H3/i1D3,14D
InChIKey
ZIJWCRNUEBJMSQ-CZEVESCESA-N
Chemical Structure
2D Structure
2D structure of 2-(1-Hydroxyethyl) Promazine-d4
CAS: 1346603-20-0
CID: 71749045
Formula: C19H24N2OS
MW: 332.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight332.5
XLogP33.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass332.18604155
Monoisotopic Mass332.18604155
Topological Polar Surface Area52 Ų
Heavy Atom Count23
Formal Charge0
Complexity378
Isotope Atom Count4
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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