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3-Hydroxypromazine

CAT: 0572-TRC-H952440-10MGSize: 10 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-H952440-10MGSize:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
316-85-8
Synonyms
10H-Phenothiazin-3-ol, 10-[3-(dimethylamino)propyl]-; Phenothiazin-3-ol, 10-[3-(dimethylamino)propyl]- (7CI,8CI); 3-Hydroxypromazine
Hazard Statement
Harmful if swallowed.
Purity
>95% (HPLC)
Smiles
CN(C)CCCN1c2ccccc2Sc3cc(O)ccc13
Molecular Formula
C17 H20 N2 O S
Molecular Weight
300.42
InChI
InChI=1S/C17H20N2OS/c1-18(2)10-5-11-19-14-6-3-4-7-16(14)21-17-12-13(20)8-9-15(17)19/h3-4,6-9,12,20H,5,10-11H2,1-2H3
Additionnal Information
IUPAC name: 10-[3-(dimethylamino)propyl]phenothiazin-3-ol
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

3-Hydroxypromazine

promazine metabolite

CAS Number316-85-8
PubChem CID67569
IUPAC Name10-[3-(dimethylamino)propyl]phenothiazin-3-ol
Molecular FormulaC17H20N2OS
Molecular Weight300.4
XLogP4.2
Topological Polar Surface Area52
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count21
Formal Charge0
Complexity339
SMILES
CN(C)CCCN1C2=C(C=C(C=C2)O)SC3=CC=CC=C31
InChI
InChI=1S/C17H20N2OS/c1-18(2)10-5-11-19-14-6-3-4-7-16(14)21-17-12-13(20)8-9-15(17)19/h3-4,6-9,12,20H,5,10-11H2,1-2H3
InChIKey
FCWHSDRYYOAXGG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-Hydroxypromazine
CAS: 316-85-8
CID: 67569
Formula: C17H20N2OS
MW: 300.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight300.4
XLogP34.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass300.12963444
Monoisotopic Mass300.12963444
Topological Polar Surface Area52 Ų
Heavy Atom Count21
Formal Charge0
Complexity339
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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