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84-08-2 | Parathiazine
CAS No: 84-08-2 Catalog No: AG00G77W MDL No:
Product Description
Catalog Number:
AG00G77W
Chemical Name:
Parathiazine
CAS Number:
84-08-2
IUPAC Name:
10-(2-pyrrolidin-1-ylethyl)phenothiazine
InChI:
InChI=1S/C18H20N2S/c1-3-9-17-15(7-1)20(14-13-19-11-5-6-12-19)16-8-2-4-10-18(16)21-17/h1-4,7-10H,5-6,11-14H2
InChI Key:
KJKJUXGEMYCCJN-UHFFFAOYSA-N
UNII:
2305SQ56Z2
Properties
Complexity:
320
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.135g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
296.432g/mol
Monoisotopic Mass:
296.135g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
31.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
Literature
| Title | Journal |
|---|---|
| Why are most phospholipidosis inducers also hERG blockers? | Archives of toxicology 20171201 |
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